3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide

C19H27NO3 — CID 126815250

IUPAC3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide
SMILESO=C(CC(c1ccc(O)cc1)C1CC1)NC1CCC(CO)CC1
InChIInChI=1S/C19H27NO3/c21-12-13-1-7-16(8-2-13)20-19(23)11-18(14-3-4-14)15-5-9-17(22)10-6-15/h5-6,9-10,13-14,16,18,21-22H,1-4,7-8,11-12H2,(H,20,23)
InChIKeyNLHPDWJGUZPLFG-UHFFFAOYSA-N
MW317.43 g/mol
LogP2.94
Rot. Bonds6

About 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide

3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide (PubChem CID 126815250) has the molecular formula C19H27NO3 and a molecular weight of 317.43 g/mol. Its IUPAC name is 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide
PubChem CID126815250
Molecular FormulaC19H27NO3
Molecular Weight317.43 g/mol
Exact Mass317.20
IUPAC Name3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide
SMILESO=C(CC(c1ccc(O)cc1)C1CC1)NC1CCC(CO)CC1
InChIInChI=1S/C19H27NO3/c21-12-13-1-7-16(8-2-13)20-19(23)11-18(14-3-4-14)15-5-9-17(22)10-6-15/h5-6,9-10,13-14,16,18,21-22H,1-4,7-8,11-12H2,(H,20,23)
InChIKeyNLHPDWJGUZPLFG-UHFFFAOYSA-N
XLogP2.94
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-cyclopropyl-3-(4-hydroxyphenyl)-N-(3-hydroxy-2-pyrazol-1-ylcyclobutyl)propanamide
CID 166254544
3-cyclopropyl-3-(4-fluorophenyl)-N-methylpropanamide
CID 82080009
4-(1-cyclobutyl-3-hydroxypropyl)phenol
CID 115024794
3-cyclopropyl-N-[(2S)-1-hydroxypropan-2-yl]-3-(4-methylphenyl)propanamide
CID 110306942
2-(2-fluorophenyl)-N-[4-(hydroxymethyl)cyclohexyl]acetamide
CID 115270081
ethyl 4-[[3-cyclopropyl-3-(3,4-dimethylphenyl)propanoyl]amino]piperidine-1-carboxylate
CID 110413273
4-[[[4-(hydroxymethyl)cyclohexyl]amino]methyl]phenol
CID 112753322
N-[4-(hydroxymethyl)cyclohexyl]-2-(4-methoxyphenyl)-2-(propan-2-ylamino)acetamide
CID 126826422
ethyl 4-[[3-cyclopropyl-3-(4-fluoro-3-methylphenyl)propanoyl]amino]piperidine-1-carboxylate
CID 110297431
(1S,5S)-1,5-dicyclopropyl-1,5-bis(4-fluorophenyl)pentan-3-one
CID 97304327
4-[2-cyclobutyl-2-(4-hydroxyphenyl)ethyl]phenol
CID 151360371
N-(4-aminocyclohexyl)-3-(4-ethylphenyl)butanamide
CID 119475429

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide?
The IUPAC name of 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide (CID 126815250) is 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide.
What is the SMILES notation for 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide?
The canonical SMILES for 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide is O=C(CC(c1ccc(O)cc1)C1CC1)NC1CCC(CO)CC1.
What is the InChIKey of 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide?
The InChIKey is NLHPDWJGUZPLFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO3/c21-12-13-1-7-16(8-2-13)20-19(23)11-18(14-3-4-14)15-5-9-17(22)10-6-15/h5-6,9-10,13-14,16,18,21-22H,1-4,7-8,11-12H2,(H,20,23).
What are the key properties of 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide?
3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide has a molecular weight of 317.43 g/mol, XLogP of 2.94, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[4-(hydroxymethyl)cyclohexyl]-3-(4-hydroxyphenyl)propanamide is sourced from PubChem (CID 126815250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).