4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide

C23H35N3O3 — CID 172670300

IUPAC4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide
SMILESCc1ccn(CC2CCCO2)c(=O)c1C(=O)NCC1(N2CCCCC2)CCCC1
InChIInChI=1S/C23H35N3O3/c1-18-9-14-25(16-19-8-7-15-29-19)22(28)20(18)21(27)24-17-23(10-3-4-11-23)26-12-5-2-6-13-26/h9,14,19H,2-8,10-13,15-17H2,1H3,(H,24,27)
InChIKeyLBFSWXOYXJXVEE-UHFFFAOYSA-N
MW401.55 g/mol
LogP2.86
Rot. Bonds6

About 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide

4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide (PubChem CID 172670300) has the molecular formula C23H35N3O3 and a molecular weight of 401.55 g/mol. Its IUPAC name is 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide
PubChem CID172670300
Molecular FormulaC23H35N3O3
Molecular Weight401.55 g/mol
Exact Mass401.27
IUPAC Name4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide
SMILESCc1ccn(CC2CCCO2)c(=O)c1C(=O)NCC1(N2CCCCC2)CCCC1
InChIInChI=1S/C23H35N3O3/c1-18-9-14-25(16-19-8-7-15-29-19)22(28)20(18)21(27)24-17-23(10-3-4-11-23)26-12-5-2-6-13-26/h9,14,19H,2-8,10-13,15-17H2,1H3,(H,24,27)
InChIKeyLBFSWXOYXJXVEE-UHFFFAOYSA-N
XLogP2.86
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.55
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide with MolForge

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Related Compounds

4-[[(2R)-oxolan-2-yl]methoxy]-N-[(1-piperidin-1-ylcyclohexyl)methyl]benzamide
CID 7824799
4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide
CID 172671508
4-methyl-N-[(2-methyl-3H-benzimidazol-5-yl)methyl]-2-oxo-1-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 172671485
4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]pyridine-3-carboxamide
CID 172672246
methyl 3-fluoro-5-[[4-methyl-2-oxo-1-(oxolan-2-ylmethyl)pyridine-3-carbonyl]amino]benzoate
CID 172656404
N-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)-4-methyl-2-oxo-1-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 172666834
4-methyl-N-(1-methylbenzotriazol-4-yl)-2-oxo-1-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 172662084
4-methyl-1-(oxolan-2-ylmethyl)-3-(4-pyrimidin-2-yl-1,4-diazepane-1-carbonyl)pyridin-2-one
CID 172666689
4-methyl-1-(3-methylbutyl)-2-oxo-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]pyridine-3-carboxamide
CID 172664709
3-[4-(2-fluorophenoxy)piperidine-1-carbonyl]-4-methyl-1-(oxolan-2-ylmethyl)pyridin-2-one
CID 172673693
4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 2559826
4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-(2-pyridin-3-yloxyphenyl)pyridine-3-carboxamide
CID 172660780

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide (CID 172670300) is 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide is Cc1ccn(CC2CCCO2)c(=O)c1C(=O)NCC1(N2CCCCC2)CCCC1.
What is the InChIKey of 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide?
The InChIKey is LBFSWXOYXJXVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35N3O3/c1-18-9-14-25(16-19-8-7-15-29-19)22(28)20(18)21(27)24-17-23(10-3-4-11-23)26-12-5-2-6-13-26/h9,14,19H,2-8,10-13,15-17H2,1H3,(H,24,27).
What are the key properties of 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide?
4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide has a molecular weight of 401.55 g/mol, XLogP of 2.86, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-[(1-piperidin-1-ylcyclopentyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 172670300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).