N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide

C20H24N2O2 — CID 111432238

IUPACN-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide
SMILESO=C(Nc1ccccc1N1CCCCCC1)C(O)c1ccccc1
InChIInChI=1S/C20H24N2O2/c23-19(16-10-4-3-5-11-16)20(24)21-17-12-6-7-13-18(17)22-14-8-1-2-9-15-22/h3-7,10-13,19,23H,1-2,8-9,14-15H2,(H,21,24)
InChIKeyMXZOVVDGJGIYMB-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.74
Rot. Bonds4

About N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide

N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide (PubChem CID 111432238) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide
PubChem CID111432238
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide
SMILESO=C(Nc1ccccc1N1CCCCCC1)C(O)c1ccccc1
InChIInChI=1S/C20H24N2O2/c23-19(16-10-4-3-5-11-16)20(24)21-17-12-6-7-13-18(17)22-14-8-1-2-9-15-22/h3-7,10-13,19,23H,1-2,8-9,14-15H2,(H,21,24)
InChIKeyMXZOVVDGJGIYMB-UHFFFAOYSA-N
XLogP3.74
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide 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

2-fluoro-2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 52914895
2,2-difluoro-N-(2-piperidin-1-ylphenyl)acetamide
CID 103600704
2-methoxy-N-(2-piperidin-1-ylphenyl)propanamide
CID 47300267
1-(2-methylphenyl)-3-(2-piperidin-1-ylphenyl)urea
CID 2814230
N-[2-(azepan-1-yl)phenyl]benzamide
CID 24652732
2-amino-N-(2-pyrrolidin-1-ylphenyl)propanamide;hydrochloride
CID 119164504
(2S)-2-phenyl-N-(2-pyrrolidin-1-ylphenyl)butanamide;2,2,2-trifluoroacetic acid
CID 50985951
2-methyl-3-(methylamino)-N-(2-pyrrolidin-1-ylphenyl)propanamide
CID 79195677
2-methyl-N-(2-pyrrolidin-1-ylphenyl)pentanamide
CID 78792531
N-(5-chloro-2-morpholin-4-ylphenyl)-2-hydroxy-2-phenylacetamide
CID 111536320
N-(2-piperidin-1-ylphenyl)propanamide
CID 960826
N-benzhydryl-2-(2-piperidin-1-ylanilino)acetamide
CID 9324469

Frequently Asked Questions

What is the IUPAC name of N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide?
The IUPAC name of N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide (CID 111432238) is N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide?
The canonical SMILES for N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide is O=C(Nc1ccccc1N1CCCCCC1)C(O)c1ccccc1.
What is the InChIKey of N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide?
The InChIKey is MXZOVVDGJGIYMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c23-19(16-10-4-3-5-11-16)20(24)21-17-12-6-7-13-18(17)22-14-8-1-2-9-15-22/h3-7,10-13,19,23H,1-2,8-9,14-15H2,(H,21,24).
What are the key properties of N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide?
N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide has a molecular weight of 324.42 g/mol, XLogP of 3.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(azepan-1-yl)phenyl]-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 111432238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).