N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide

C28H27N3O — CID 24685354

IUPACN-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide
SMILESCc1ccc2nc(-c3ccc(NC(=O)CN4CCCC4)cc3)cc(-c3ccccc3)c2c1
InChIInChI=1S/C28H27N3O/c1-20-9-14-26-25(17-20)24(21-7-3-2-4-8-21)18-27(30-26)22-10-12-23(13-11-22)29-28(32)19-31-15-5-6-16-31/h2-4,7-14,17-18H,5-6,15-16,19H2,1H3,(H,29,32)
InChIKeyCHSMPIUZXLPBGT-UHFFFAOYSA-N
MW421.54 g/mol
LogP5.91
Rot. Bonds5

About N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide

N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide (PubChem CID 24685354) has the molecular formula C28H27N3O and a molecular weight of 421.54 g/mol. Its IUPAC name is N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide
PubChem CID24685354
Molecular FormulaC28H27N3O
Molecular Weight421.54 g/mol
Exact Mass421.22
IUPAC NameN-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide
SMILESCc1ccc2nc(-c3ccc(NC(=O)CN4CCCC4)cc3)cc(-c3ccccc3)c2c1
InChIInChI=1S/C28H27N3O/c1-20-9-14-26-25(17-20)24(21-7-3-2-4-8-21)18-27(30-26)22-10-12-23(13-11-22)29-28(32)19-31-15-5-6-16-31/h2-4,7-14,17-18H,5-6,15-16,19H2,1H3,(H,29,32)
InChIKeyCHSMPIUZXLPBGT-UHFFFAOYSA-N
XLogP5.91
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.54
LogP ≤ 55.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide 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-(4-acetamidophenyl)-6-methyl-N-(3-piperidin-1-ylpropyl)quinoline-4-carboxamide
CID 46375387
N,6-dimethyl-2-phenyl-N-(2-pyrrolidin-1-ylethyl)quinoline-4-carboxamide
CID 166190703
2-[4-(6-methyl-4-phenylquinolin-2-yl)phenoxy]-1-morpholin-4-ylethanone
CID 39860435
N-[4-[4-(pyrrolidine-1-carbonyl)quinolin-2-yl]phenyl]acetamide
CID 50816149
2-(azocan-1-yl)-N-(3-methylphenyl)acetamide
CID 2655272
N-(4-methylphenyl)-2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]acetamide
CID 4606267
N-(6-methyl-1,3-benzothiazol-2-yl)-2-[4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]acetamide
CID 30485980
N-(4-methylphenyl)-2-(8-methyl-3-phenylpyrazolo[4,3-c]quinolin-1-yl)acetamide
CID 20952230
6-methyl-2-(4-pyrrolidin-1-ylphenyl)quinoline-4-carboxylic acid
CID 168514407
2-(4-acetamidophenyl)-6-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]quinoline-4-carboxamide
CID 46375393
2-(4-acetamidophenyl)-6-methyl-N-[2-[(2S)-2-methylpiperidin-1-yl]ethyl]quinoline-4-carboxamide
CID 92879171
2-(4-acetylpiperazin-1-yl)-N-(4-methylphenyl)acetamide
CID 2697560

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide (CID 24685354) is N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide is Cc1ccc2nc(-c3ccc(NC(=O)CN4CCCC4)cc3)cc(-c3ccccc3)c2c1.
What is the InChIKey of N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide?
The InChIKey is CHSMPIUZXLPBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27N3O/c1-20-9-14-26-25(17-20)24(21-7-3-2-4-8-21)18-27(30-26)22-10-12-23(13-11-22)29-28(32)19-31-15-5-6-16-31/h2-4,7-14,17-18H,5-6,15-16,19H2,1H3,(H,29,32).
What are the key properties of N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide?
N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide has a molecular weight of 421.54 g/mol, XLogP of 5.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 24685354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).