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Propanamide, N-(1-cyclohexylethyl)-

PubChem CID: 541858

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Compound Synonyms Propanamide, N-(1-cyclohexylethyl)-, SCHEMBL18314658, UJLBXKVAHYJFRP-UHFFFAOYSA-N, N-(1-Cyclohexylethyl)propanamide #, AKOS013918489
Topological Polar Surface Area 29.1
Hydrogen Bond Donor Count 1.0
Heavy Atom Count 13.0
Isotope Atom Count 0.0
Molecular Complexity 161.0
Database Name cmaup_ingredients;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name N-(1-cyclohexylethyl)propanamide
Prediction Hob 1.0
Xlogp 2.8
Molecular Formula C11H21NO
Prediction Swissadme 1.0
Inchi Key UJLBXKVAHYJFRP-UHFFFAOYSA-N
Fcsp3 0.9090909090909092
Logs -2.596
Rotatable Bond Count 3.0
Logd 2.799
Compound Name Propanamide, N-(1-cyclohexylethyl)-
Prediction Hob Swissadme 1.0
Exact Mass 183.162
Formal Charge 0.0
Monoisotopic Mass 183.162
Hydrogen Bond Acceptor Count 1.0
Molecular Weight 183.29
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Esol -2.7566289999999998
Inchi InChI=1S/C11H21NO/c1-3-11(13)12-9(2)10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3,(H,12,13)
Smiles CCC(=O)NC(C)C1CCCCC1
Nring 1.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Hypericum Japonicum (Plant) Rel Props:Source_db:cmaup_ingredients