N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide

C25H25N3O4 — CID 163680968

IUPACN-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide
SMILESCOc1ccc(C(=O)N[C@@H]2CCCC2NC(=O)c2ccc(-n3ccccc3=O)cc2)cc1
InChIInChI=1S/C25H25N3O4/c1-32-20-14-10-18(11-15-20)25(31)27-22-6-4-5-21(22)26-24(30)17-8-12-19(13-9-17)28-16-3-2-7-23(28)29/h2-3,7-16,21-22H,4-6H2,1H3,(H,26,30)(H,27,31)/t21?,22-/m1/s1
InChIKeyJKUJBLQHBLGTSY-FOIFJWKZSA-N
MW431.49 g/mol
LogP2.93
Rot. Bonds6

About N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide

N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide (PubChem CID 163680968) has the molecular formula C25H25N3O4 and a molecular weight of 431.49 g/mol. Its IUPAC name is N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide.

Molecular Properties

Compound NameN-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide
PubChem CID163680968
Molecular FormulaC25H25N3O4
Molecular Weight431.49 g/mol
Exact Mass431.18
IUPAC NameN-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide
SMILESCOc1ccc(C(=O)N[C@@H]2CCCC2NC(=O)c2ccc(-n3ccccc3=O)cc2)cc1
InChIInChI=1S/C25H25N3O4/c1-32-20-14-10-18(11-15-20)25(31)27-22-6-4-5-21(22)26-24(30)17-8-12-19(13-9-17)28-16-3-2-7-23(28)29/h2-3,7-16,21-22H,4-6H2,1H3,(H,26,30)(H,27,31)/t21?,22-/m1/s1
InChIKeyJKUJBLQHBLGTSY-FOIFJWKZSA-N
XLogP2.93
TPSA89.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.49
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[(4-chlorobenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide
CID 75027304
tert-butyl N-[(1S)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclopentyl]carbamate
CID 142943619
4-chloro-2-methyl-N-[(1R)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclopentyl]benzamide
CID 142943661
4-chloro-3-fluoro-N-[(2S)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclopentyl]benzamide
CID 71189210
5-chloro-N-[(1S,2R)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclopentyl]-1H-indole-2-carboxamide
CID 11213659
N-[(1S,2R)-2-[(6-chloronaphthalen-2-yl)sulfonylamino]cyclohexyl]-4-(2-oxo-1-pyridinyl)benzamide;sulfane
CID 160852973
N-cyclohexyl-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 91945533
6-chloro-N-[(1R,2S)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclohexyl]-1-benzothiophene-2-carboxamide
CID 11306712
N'-(5-chloro-2-pyridinyl)-N-[(1R,2S)-2-[[4-(2-oxo-1-pyridinyl)benzoyl]amino]cyclopentyl]oxamide
CID 11363623
N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-methoxybenzamide
CID 51665263
N-(4-amino-1-methyl-5-oxopyrrolidin-3-yl)-4-(2-oxo-1-pyridinyl)benzamide
CID 69442634
N-[(1S,3S)-3-hydroxycyclohexyl]-4-methoxybenzamide
CID 95983830

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide?
The IUPAC name of N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide (CID 163680968) is N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide.
What is the SMILES notation for N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide?
The canonical SMILES for N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide is COc1ccc(C(=O)N[C@@H]2CCCC2NC(=O)c2ccc(-n3ccccc3=O)cc2)cc1.
What is the InChIKey of N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide?
The InChIKey is JKUJBLQHBLGTSY-FOIFJWKZSA-N. The full InChI is InChI=1S/C25H25N3O4/c1-32-20-14-10-18(11-15-20)25(31)27-22-6-4-5-21(22)26-24(30)17-8-12-19(13-9-17)28-16-3-2-7-23(28)29/h2-3,7-16,21-22H,4-6H2,1H3,(H,26,30)(H,27,31)/t21?,22-/m1/s1.
What are the key properties of N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide?
N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide has a molecular weight of 431.49 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-[(4-methoxybenzoyl)amino]cyclopentyl]-4-(2-oxo-1-pyridinyl)benzamide is sourced from PubChem (CID 163680968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).