N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide

C18H22N4O2 — CID 166226689

IUPACN-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide
SMILESCc1cccc(NC(=O)C2CCN(C(=O)c3cc[nH]c3C)CC2)n1
InChIInChI=1S/C18H22N4O2/c1-12-4-3-5-16(20-12)21-17(23)14-7-10-22(11-8-14)18(24)15-6-9-19-13(15)2/h3-6,9,14,19H,7-8,10-11H2,1-2H3,(H,20,21,23)
InChIKeyVPIZAJCLXRARCZ-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.52
Rot. Bonds3

About N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide

N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide (PubChem CID 166226689) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide
PubChem CID166226689
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide
SMILESCc1cccc(NC(=O)C2CCN(C(=O)c3cc[nH]c3C)CC2)n1
InChIInChI=1S/C18H22N4O2/c1-12-4-3-5-16(20-12)21-17(23)14-7-10-22(11-8-14)18(24)15-6-9-19-13(15)2/h3-6,9,14,19H,7-8,10-11H2,1-2H3,(H,20,21,23)
InChIKeyVPIZAJCLXRARCZ-UHFFFAOYSA-N
XLogP2.52
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1H-indazole-3-carbonyl)-N-(6-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 47066202
1-N,4-N-bis(6-methyl-2-pyridinyl)cyclohexane-1,4-dicarboxamide
CID 25469709
N-(6-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 22690147
1-(2-chlorobenzoyl)-N-(6-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 55813036
(4-aminopiperidin-1-yl)-(2-methyl-1H-pyrrol-3-yl)methanone
CID 119376460
N-(6-methyl-2-pyridinyl)-1-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidine-4-carboxamide
CID 94821290
1-[(2R)-2-butylsulfanylpropanoyl]-N-(6-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 52515347
1-(6-methylpyridine-2-carbonyl)-N-phenylpiperidine-4-carboxamide
CID 32565194
(2-methyl-1H-pyrrol-3-yl)-[4-(trifluoromethyl)piperidin-1-yl]methanone
CID 126739502
N-(6-methyl-2-pyridinyl)-1-(2-methylsulfonylphenyl)sulfonylpiperidine-4-carboxamide
CID 16935097
cis-(1R,3S)-3-[(6-methyl-2-pyridinyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 95401115
N-(6-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 43185838

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide (CID 166226689) is N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide is Cc1cccc(NC(=O)C2CCN(C(=O)c3cc[nH]c3C)CC2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide?
The InChIKey is VPIZAJCLXRARCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-12-4-3-5-16(20-12)21-17(23)14-7-10-22(11-8-14)18(24)15-6-9-19-13(15)2/h3-6,9,14,19H,7-8,10-11H2,1-2H3,(H,20,21,23).
What are the key properties of N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide?
N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-1-(2-methyl-1H-pyrrole-3-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 166226689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).