1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide

C17H24N4O2 — CID 126796587

IUPAC1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
SMILESCc1ccc(N2CCC(NC(=O)C3CCC(=O)N3C)CC2)nc1
InChIInChI=1S/C17H24N4O2/c1-12-3-5-15(18-11-12)21-9-7-13(8-10-21)19-17(23)14-4-6-16(22)20(14)2/h3,5,11,13-14H,4,6-10H2,1-2H3,(H,19,23)
InChIKeyGWAVXQVZXCLPHM-UHFFFAOYSA-N
MW316.40 g/mol
LogP1.10
Rot. Bonds3

About 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide

1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide (PubChem CID 126796587) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
PubChem CID126796587
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC Name1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
SMILESCc1ccc(N2CCC(NC(=O)C3CCC(=O)N3C)CC2)nc1
InChIInChI=1S/C17H24N4O2/c1-12-3-5-15(18-11-12)21-9-7-13(8-10-21)19-17(23)14-4-6-16(22)20(14)2/h3,5,11,13-14H,4,6-10H2,1-2H3,(H,19,23)
InChIKeyGWAVXQVZXCLPHM-UHFFFAOYSA-N
XLogP1.10
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-2-hydroxy-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]propanamide
CID 154757649
2,5-dimethyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]pyrazole-3-carboxamide
CID 172899602
N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-3-(4-phenylpiperazin-1-yl)propanamide
CID 91026152
1-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]ethanone
CID 63845665
2-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-2-pyrazol-1-ylpropanamide
CID 138034610
N-methyl-1-(5-methyl-2-pyridinyl)pyrrolidin-3-amine
CID 59535689
2-methyl-1-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]propan-1-one
CID 155710623
tert-butyl N-[(3S)-1-(5-methyl-2-pyridinyl)pyrrolidin-3-yl]carbamate
CID 71634683
tert-butyl N-[(3R)-1-(5-methyl-2-pyridinyl)pyrrolidin-3-yl]carbamate
CID 71634685
1-methyl-N-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110687248
1-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-3-(2-pyridin-4-ylphenyl)urea
CID 126768475
(1S,2R,3S,4R)-3-[[1-(5-methyl-2-pyridinyl)piperidine-4-carbonyl]amino]bicyclo[2.2.1]heptane-2-carboxylic acid
CID 154867230

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide (CID 126796587) is 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide is Cc1ccc(N2CCC(NC(=O)C3CCC(=O)N3C)CC2)nc1.
What is the InChIKey of 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide?
The InChIKey is GWAVXQVZXCLPHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-12-3-5-15(18-11-12)21-9-7-13(8-10-21)19-17(23)14-4-6-16(22)20(14)2/h3,5,11,13-14H,4,6-10H2,1-2H3,(H,19,23).
What are the key properties of 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide?
1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide has a molecular weight of 316.40 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 126796587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).