2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide

C30H29N3O2 — CID 112794963

IUPAC2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
SMILESCc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C30H29N3O2/c1-21-25(29(22-12-4-2-5-13-22)23-14-6-8-16-26(23)31-21)20-28(34)32-27-17-9-7-15-24(27)30(35)33-18-10-3-11-19-33/h2,4-9,12-17H,3,10-11,18-20H2,1H3,(H,32,34)
InChIKeyNEUOVYSZOXIUDN-UHFFFAOYSA-N
MW463.58 g/mol
LogP6.02
Rot. Bonds5

About 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide

2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide (PubChem CID 112794963) has the molecular formula C30H29N3O2 and a molecular weight of 463.58 g/mol. Its IUPAC name is 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
PubChem CID112794963
Molecular FormulaC30H29N3O2
Molecular Weight463.58 g/mol
Exact Mass463.23
IUPAC Name2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
SMILESCc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C30H29N3O2/c1-21-25(29(22-12-4-2-5-13-22)23-14-6-8-16-26(23)31-21)20-28(34)32-27-17-9-7-15-24(27)30(35)33-18-10-3-11-19-33/h2,4-9,12-17H,3,10-11,18-20H2,1H3,(H,32,34)
InChIKeyNEUOVYSZOXIUDN-UHFFFAOYSA-N
XLogP6.02
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.58
LogP ≤ 56.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxyphenyl)-2-(2-methyl-4-phenylquinolin-3-yl)acetamide
CID 112790890
2-(2-methyl-4-phenylquinolin-3-yl)-N-propan-2-ylacetamide
CID 112759088
2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 35277586
1-(4-acetylpiperazin-1-yl)-2-(2-methyl-4-phenylquinolin-3-yl)ethanone
CID 112762995
N-[2-(piperidine-1-carbonyl)phenyl]-2-thiophen-3-ylacetamide
CID 17425313
2-(4-acetamidophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 78806404
methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate
CID 146289922
4-chloro-N,N-dimethyl-3-[[2-(2-methyl-4-phenylquinolin-3-yl)acetyl]amino]benzamide
CID 112822286
N-(1-hydroxypropan-2-yl)-2-(2-methyl-4-phenylquinolin-3-yl)acetamide
CID 110887326
N-(3-hydroxypropyl)-2-(2-methyl-4-phenylquinolin-3-yl)acetamide
CID 110878183
N,N-dimethyl-4-[2-(2-methyl-4-phenylquinolin-3-yl)acetyl]piperazine-1-carboxamide
CID 86981009
2-amino-N-[2-(piperidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119268834

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide (CID 112794963) is 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide is Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccccc1C(=O)N1CCCCC1.
What is the InChIKey of 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide?
The InChIKey is NEUOVYSZOXIUDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H29N3O2/c1-21-25(29(22-12-4-2-5-13-22)23-14-6-8-16-26(23)31-21)20-28(34)32-27-17-9-7-15-24(27)30(35)33-18-10-3-11-19-33/h2,4-9,12-17H,3,10-11,18-20H2,1H3,(H,32,34).
What are the key properties of 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide?
2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide has a molecular weight of 463.58 g/mol, XLogP of 6.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-4-phenylquinolin-3-yl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 112794963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).