N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide

C22H22N2O2 — CID 97081084

IUPACN-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide
SMILESO=C(Cc1cc2ccccc2[nH]c1=O)N[C@@H](c1ccccc1)C1CCC1
InChIInChI=1S/C22H22N2O2/c25-20(14-18-13-17-9-4-5-12-19(17)23-22(18)26)24-21(16-10-6-11-16)15-7-2-1-3-8-15/h1-5,7-9,12-13,16,21H,6,10-11,14H2,(H,23,26)(H,24,25)/t21-/m0/s1
InChIKeyACOQFVOUZDIOPA-NRFANRHFSA-N
MW346.43 g/mol
LogP3.73
Rot. Bonds5

About N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide

N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide (PubChem CID 97081084) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide.

Molecular Properties

Compound NameN-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide
PubChem CID97081084
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC NameN-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide
SMILESO=C(Cc1cc2ccccc2[nH]c1=O)N[C@@H](c1ccccc1)C1CCC1
InChIInChI=1S/C22H22N2O2/c25-20(14-18-13-17-9-4-5-12-19(17)23-22(18)26)24-21(16-10-6-11-16)15-7-2-1-3-8-15/h1-5,7-9,12-13,16,21H,6,10-11,14H2,(H,23,26)(H,24,25)/t21-/m0/s1
InChIKeyACOQFVOUZDIOPA-NRFANRHFSA-N
XLogP3.73
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide 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

N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide
CID 2203053
N-(1-naphthalen-2-ylethyl)-2-(2-oxo-1H-quinolin-3-yl)acetamide
CID 51115860
3-[(2-oxo-1H-quinolin-3-yl)methylamino]-3-phenylpropanoic acid
CID 166226957
N-[cyclopentyl(phenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 2964253
N-cyclohexyl-N-cyclopropyl-2-(2-oxo-1H-quinolin-3-yl)acetamide
CID 56820333
3-cyclopropyl-3-(4-methoxyphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 110616654
3-amino-N-[cyclobutyl(phenyl)methyl]-3-phenylpropanamide
CID 119951252
N'-(3-bicyclo[3.3.1]nonanyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxamide
CID 167835459
N-[(S)-(4-chlorophenyl)-cyclopentylmethyl]-N-methyl-2-(2-oxo-1H-quinolin-3-yl)acetamide
CID 100696835
(2R)-1-[2-(2-oxo-1H-quinolin-3-yl)acetyl]pyrrolidine-2-carboxylic acid
CID 119372066
2-(4-chlorophenyl)-2-cyclopropyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616683
N-[(2S)-1-(4-chlorophenyl)propan-2-yl]-2-(2-oxo-1H-quinolin-3-yl)acetamide
CID 51949830

Frequently Asked Questions

What is the IUPAC name of N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide?
The IUPAC name of N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide (CID 97081084) is N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide.
What is the SMILES notation for N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide?
The canonical SMILES for N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide is O=C(Cc1cc2ccccc2[nH]c1=O)N[C@@H](c1ccccc1)C1CCC1.
What is the InChIKey of N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide?
The InChIKey is ACOQFVOUZDIOPA-NRFANRHFSA-N. The full InChI is InChI=1S/C22H22N2O2/c25-20(14-18-13-17-9-4-5-12-19(17)23-22(18)26)24-21(16-10-6-11-16)15-7-2-1-3-8-15/h1-5,7-9,12-13,16,21H,6,10-11,14H2,(H,23,26)(H,24,25)/t21-/m0/s1.
What are the key properties of N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide?
N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide has a molecular weight of 346.43 g/mol, XLogP of 3.73, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-cyclobutyl(phenyl)methyl]-2-(2-oxo-1H-quinolin-3-yl)acetamide is sourced from PubChem (CID 97081084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).