N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide

C25H32N4O3 — CID 92635351

IUPACN-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccccc1)c1cccn(CC(=O)N2CCCC[C@@H]2CN2CCCC2)c1=O
InChIInChI=1S/C25H32N4O3/c30-23(29-16-5-4-11-21(29)18-27-13-6-7-14-27)19-28-15-8-12-22(25(28)32)24(31)26-17-20-9-2-1-3-10-20/h1-3,8-10,12,15,21H,4-7,11,13-14,16-19H2,(H,26,31)/t21-/m1/s1
InChIKeyYNSVATDDVUFYDS-OAQYLSRUSA-N
MW436.56 g/mol
LogP2.26
Rot. Bonds7

About N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide

N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide (PubChem CID 92635351) has the molecular formula C25H32N4O3 and a molecular weight of 436.56 g/mol. Its IUPAC name is N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide
PubChem CID92635351
Molecular FormulaC25H32N4O3
Molecular Weight436.56 g/mol
Exact Mass436.25
IUPAC NameN-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccccc1)c1cccn(CC(=O)N2CCCC[C@@H]2CN2CCCC2)c1=O
InChIInChI=1S/C25H32N4O3/c30-23(29-16-5-4-11-21(29)18-27-13-6-7-14-27)19-28-15-8-12-22(25(28)32)24(31)26-17-20-9-2-1-3-10-20/h1-3,8-10,12,15,21H,4-7,11,13-14,16-19H2,(H,26,31)/t21-/m1/s1
InChIKeyYNSVATDDVUFYDS-OAQYLSRUSA-N
XLogP2.26
TPSA74.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.56
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide 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-benzyl-1-[2-[(2S)-2-(3,4-dimethylphenyl)pyrrolidin-1-yl]-2-oxoethyl]-2-oxopyridine-3-carboxamide
CID 92635526
N-benzyl-1-[2-[(2S)-2-(2,5-dimethylphenyl)pyrrolidin-1-yl]-2-oxoethyl]-2-oxopyridine-3-carboxamide
CID 92635426
1-[2-[(2S)-2-benzylpiperidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 95298452
[(3S)-2-oxo-1-[2-oxo-2-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]ethyl]piperidin-3-yl] N-benzylcarbamate
CID 91513499
N-benzyl-1-[2-[(3R)-3-[(2-methylimidazol-1-yl)methyl]piperidin-1-yl]-2-oxoethyl]-2-oxopyridine-3-carboxamide
CID 92635435
N-[2-[(2-fluorobenzoyl)amino]ethyl]-2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide
CID 136523994
2-[3-(cyclopropylmethylcarbamoyl)-2-oxo-1-pyridinyl]acetic acid
CID 110082553
N-[(4-methylphenyl)methyl]-2-[[2-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]acetyl]amino]benzamide
CID 56542148
2-phenylmethoxy-1-[(2R)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]ethanone
CID 94819194
3-methoxy-1-[2-[(2R)-2-(3-methoxypropyl)piperidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 97281858
3-methoxy-1-[2-[2-(3-methoxypropyl)piperidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 72913931
3-[2-[2-(morpholin-4-ylmethyl)piperidin-1-yl]-2-oxoethyl]quinazolin-4-one
CID 70771844

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide?
The IUPAC name of N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide (CID 92635351) is N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide.
What is the SMILES notation for N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide?
The canonical SMILES for N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide is O=C(NCc1ccccc1)c1cccn(CC(=O)N2CCCC[C@@H]2CN2CCCC2)c1=O.
What is the InChIKey of N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide?
The InChIKey is YNSVATDDVUFYDS-OAQYLSRUSA-N. The full InChI is InChI=1S/C25H32N4O3/c30-23(29-16-5-4-11-21(29)18-27-13-6-7-14-27)19-28-15-8-12-22(25(28)32)24(31)26-17-20-9-2-1-3-10-20/h1-3,8-10,12,15,21H,4-7,11,13-14,16-19H2,(H,26,31)/t21-/m1/s1.
What are the key properties of N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide?
N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide has a molecular weight of 436.56 g/mol, XLogP of 2.26, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-oxo-1-[2-oxo-2-[(2R)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 92635351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).