N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide

C16H24N4O — CID 61019544

IUPACN-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide
SMILESCc1ccc(NC(=O)C2CCCN2C2CCNCC2)nc1
InChIInChI=1S/C16H24N4O/c1-12-4-5-15(18-11-12)19-16(21)14-3-2-10-20(14)13-6-8-17-9-7-13/h4-5,11,13-14,17H,2-3,6-10H2,1H3,(H,18,19,21)
InChIKeyLROFIPYSKXYRRZ-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.54
Rot. Bonds3

About N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide

N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide (PubChem CID 61019544) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide
PubChem CID61019544
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide
SMILESCc1ccc(NC(=O)C2CCCN2C2CCNCC2)nc1
InChIInChI=1S/C16H24N4O/c1-12-4-5-15(18-11-12)19-16(21)14-3-2-10-20(14)13-6-8-17-9-7-13/h4-5,11,13-14,17H,2-3,6-10H2,1H3,(H,18,19,21)
InChIKeyLROFIPYSKXYRRZ-UHFFFAOYSA-N
XLogP1.54
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide
CID 61019426
N-(5-methyl-2-pyridinyl)-1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carboxamide
CID 55523063
N-(4-chlorophenyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide
CID 61020001
(2S)-N-methyl-1-piperidin-4-ylpyrrolidine-2-carboxamide
CID 93446902
(2-methylphenyl)-(1-piperidin-4-ylpyrrolidin-2-yl)methanone
CID 116559771
1-(4-methoxypiperidine-4-carbonyl)-N-(5-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 119855248
1-piperidin-4-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyrrolidine-2-carboxamide
CID 106282622
N-(5-methyl-2-pyridinyl)azepan-4-amine
CID 107173810
N-carbamoyl-1-piperidin-4-ylpyrrolidine-2-carboxamide
CID 79195257
2-methyl-2-[(1-piperidin-4-ylpyrrolidine-2-carbonyl)amino]propanoic acid
CID 61265351
(2S)-2-[(1-piperidin-4-ylpyrrolidine-2-carbonyl)amino]propanoic acid
CID 78967717
N-(5-methyl-2-pyridinyl)-1-(2-pyrrolidin-2-ylacetyl)piperidine-4-carboxamide
CID 119855182

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide?
The IUPAC name of N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide (CID 61019544) is N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide is Cc1ccc(NC(=O)C2CCCN2C2CCNCC2)nc1.
What is the InChIKey of N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide?
The InChIKey is LROFIPYSKXYRRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-12-4-5-15(18-11-12)19-16(21)14-3-2-10-20(14)13-6-8-17-9-7-13/h4-5,11,13-14,17H,2-3,6-10H2,1H3,(H,18,19,21).
What are the key properties of N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide?
N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-pyridinyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 61019544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).