2-Hydroxy-N,2,3,3-tetramethylbutanamide
PubChem CID: 568041
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| Compound Synonyms | 2-Hydroxy-N,2,3,3-tetramethylbutanamide, 87920-05-6, DTXSID30340845, Butanamide, 2-hydroxy-N,2,3,3-tetramethyl-, DTXCID50291926, BEJFIPVINMMCAV-UHFFFAOYSA-N, 2-Hydroxy-N,2,3,3-tetramethylbutanamide # |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 49.3 |
| Hydrogen Bond Donor Count | 2.0 |
| Pfizer 3 75 Rule | False |
| Deep Smiles | CNC=O)CCC)C)C))O)C |
| Heavy Atom Count | 11.0 |
| Classyfire Class | Fatty acyls |
| Classyfire Subclass | Fatty amides |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 160.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-hydroxy-N,2,3,3-tetramethylbutanamide |
| Veber Rule | True |
| Classyfire Superclass | Lipids and lipid-like molecules |
| Xlogp | 0.8 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C8H17NO2 |
| Inchi Key | BEJFIPVINMMCAV-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 2.0 |
| Synonyms | 2-hydroxy-n,2,3,3-tetramethyl-butanamide |
| Esol Class | Very soluble |
| Functional Groups | CNC(C)=O, CO |
| Compound Name | 2-Hydroxy-N,2,3,3-tetramethylbutanamide |
| Exact Mass | 159.126 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 159.126 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 159.23 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C8H17NO2/c1-7(2,3)8(4,11)6(10)9-5/h11H,1-5H3,(H,9,10) |
| Smiles | CC(C)(C)C(C)(C(=O)NC)O |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
- 1. Outgoing r'ship
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