N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide

C17H24N2O3 — CID 110882867

IUPACN-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide
SMILESO=C(Cc1ccccc1)NCCC(=O)NC1CCC(O)CC1
InChIInChI=1S/C17H24N2O3/c20-15-8-6-14(7-9-15)19-16(21)10-11-18-17(22)12-13-4-2-1-3-5-13/h1-5,14-15,20H,6-12H2,(H,18,22)(H,19,21)
InChIKeyCRPDGXFZZPTHLV-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.16
Rot. Bonds6

About N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide

N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide (PubChem CID 110882867) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide
PubChem CID110882867
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide
SMILESO=C(Cc1ccccc1)NCCC(=O)NC1CCC(O)CC1
InChIInChI=1S/C17H24N2O3/c20-15-8-6-14(7-9-15)19-16(21)10-11-18-17(22)12-13-4-2-1-3-5-13/h1-5,14-15,20H,6-12H2,(H,18,22)(H,19,21)
InChIKeyCRPDGXFZZPTHLV-UHFFFAOYSA-N
XLogP1.16
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]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

cis-(1R,3S)-3-[3-[(2-phenylacetyl)amino]propanoylamino]cyclopentane-1-carboxylic acid
CID 120678404
N-[3-[(4-hydroxycyclohexyl)amino]-3-oxopropyl]furan-2-carboxamide
CID 43389127
N-cyclopropyl-2-phenylacetamide
CID 5175687
N-cyclopropyl-3-[[2-(1H-indol-3-yl)acetyl]amino]propanamide
CID 79382425
N-(2-methylcyclohexyl)-3-[(2-phenylacetyl)amino]propanamide
CID 24593173
N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-3-[(2-phenylacetyl)amino]propanamide
CID 111658786
N-(4-hydroxycyclohexyl)-3-(2-hydroxyphenyl)propanamide
CID 43394595
5-hydroxy-N-(4-hydroxycyclohexyl)-6-phenylhexanamide
CID 155634822
3-[3-[(2-phenylacetyl)amino]propanoylamino]propanoic acid
CID 119177045
N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876
N-[3-(cyclopropylamino)propyl]-2-phenylacetamide
CID 43596486
N-(4-hydroxycyclohexyl)-2-pyridin-4-ylacetamide
CID 43508886

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide (CID 110882867) is N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide is O=C(Cc1ccccc1)NCCC(=O)NC1CCC(O)CC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide?
The InChIKey is CRPDGXFZZPTHLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c20-15-8-6-14(7-9-15)19-16(21)10-11-18-17(22)12-13-4-2-1-3-5-13/h1-5,14-15,20H,6-12H2,(H,18,22)(H,19,21).
What are the key properties of N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide?
N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide has a molecular weight of 304.39 g/mol, XLogP of 1.16, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-3-[(2-phenylacetyl)amino]propanamide is sourced from PubChem (CID 110882867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).