6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide

C25H27N5O4 — CID 110152826

IUPAC6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccc(C3CCCN3C(=O)CCn3c(C)cc(O)cc3=O)n2)nc1
InChIInChI=1S/C25H27N5O4/c1-16-8-9-22(26-15-16)28-25(34)20-6-3-5-19(27-20)21-7-4-11-30(21)23(32)10-12-29-17(2)13-18(31)14-24(29)33/h3,5-6,8-9,13-15,21,31H,4,7,10-12H2,1-2H3,(H,26,28,34)
InChIKeyAMYJAOCHYKBAQA-UHFFFAOYSA-N
MW461.52 g/mol
LogP2.97
Rot. Bonds6

About 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide

6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide (PubChem CID 110152826) has the molecular formula C25H27N5O4 and a molecular weight of 461.52 g/mol. Its IUPAC name is 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide
PubChem CID110152826
Molecular FormulaC25H27N5O4
Molecular Weight461.52 g/mol
Exact Mass461.21
IUPAC Name6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccc(C3CCCN3C(=O)CCn3c(C)cc(O)cc3=O)n2)nc1
InChIInChI=1S/C25H27N5O4/c1-16-8-9-22(26-15-16)28-25(34)20-6-3-5-19(27-20)21-7-4-11-30(21)23(32)10-12-29-17(2)13-18(31)14-24(29)33/h3,5-6,8-9,13-15,21,31H,4,7,10-12H2,1-2H3,(H,26,28,34)
InChIKeyAMYJAOCHYKBAQA-UHFFFAOYSA-N
XLogP2.97
TPSA117.42 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.52
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-[1-[3-(3,5-dioxomorpholin-4-yl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 110122471
6-[(2R)-1-[3-[(4,6-dimethylpyrimidin-2-yl)amino]propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 124987317
6-[(2R)-1-[2-[3-(dimethylamino)phenoxy]acetyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 124945798
6-[(2R)-1-[1-(1-methylpiperidin-4-yl)piperidine-4-carbonyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 124956223
N-(5-methyl-2-pyridinyl)-6-[(2S)-1-[4-(pyrazol-1-ylmethyl)benzoyl]pyrrolidin-2-yl]pyridine-2-carboxamide
CID 125014801
6-[(2S)-1-[3-(imidazol-1-ylmethyl)benzoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 125005305
4,6-dimethyl-1-[3-[2-[6-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]pyrrolidin-1-yl]-3-oxopropyl]pyrimidin-2-one
CID 110265230
4-hydroxy-6-methyl-1-[4-[(2S)-2-(1-methylbenzimidazol-2-yl)pyrrolidin-1-yl]-4-oxobutyl]pyridin-2-one
CID 91822587
4-hydroxy-6-methyl-1-[4-[2-(1-methylbenzimidazol-2-yl)pyrrolidin-1-yl]-4-oxobutyl]pyridin-2-one
CID 171145175
1-methyl-3-[3-[2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]-3-oxopropyl]benzimidazol-2-one
CID 136515688
6-[(2S)-1-acetylpyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
CID 95816016
6-[(2R)-1-acetylpyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
CID 95816015

Frequently Asked Questions

What is the IUPAC name of 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide (CID 110152826) is 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide is Cc1ccc(NC(=O)c2cccc(C3CCCN3C(=O)CCn3c(C)cc(O)cc3=O)n2)nc1.
What is the InChIKey of 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide?
The InChIKey is AMYJAOCHYKBAQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N5O4/c1-16-8-9-22(26-15-16)28-25(34)20-6-3-5-19(27-20)21-7-4-11-30(21)23(32)10-12-29-17(2)13-18(31)14-24(29)33/h3,5-6,8-9,13-15,21,31H,4,7,10-12H2,1-2H3,(H,26,28,34).
What are the key properties of 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide?
6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide has a molecular weight of 461.52 g/mol, XLogP of 2.97, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-[3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanoyl]pyrrolidin-2-yl]-N-(5-methyl-2-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 110152826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).