N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide

C17H19N3O — CID 109225773

IUPACN-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cncc(N3CCCC3)c2)c1
InChIInChI=1S/C17H19N3O/c1-13-5-4-6-15(9-13)19-17(21)14-10-16(12-18-11-14)20-7-2-3-8-20/h4-6,9-12H,2-3,7-8H2,1H3,(H,19,21)
InChIKeyREZDSNFCWQZNGV-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.24
Rot. Bonds3

About N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide

N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide (PubChem CID 109225773) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
PubChem CID109225773
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cncc(N3CCCC3)c2)c1
InChIInChI=1S/C17H19N3O/c1-13-5-4-6-15(9-13)19-17(21)14-10-16(12-18-11-14)20-7-2-3-8-20/h4-6,9-12H,2-3,7-8H2,1H3,(H,19,21)
InChIKeyREZDSNFCWQZNGV-UHFFFAOYSA-N
XLogP3.24
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylphenyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridine-3-carboxamide
CID 109238727
N-(3-chlorophenyl)-5-piperidin-1-ylpyridine-3-carboxamide
CID 109226552
N-(3-chloro-4-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225803
N-(4-acetamidophenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225827
N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102907
N-(4-acetamidophenyl)-5-(azepan-1-yl)pyridine-3-carboxamide
CID 109241376
5-piperidin-1-yl-N-(4-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
CID 109226589
5-piperidin-1-yl-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 109226590
5-(azepan-1-yl)-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide
CID 109232264
N-[(3-methylphenyl)methyl]-5-piperidin-1-ylpyridine-3-carboxamide
CID 109226461
5-hydroxy-N-(3-methylphenyl)pyridine-3-carboxamide
CID 63865627
N-(3-acetylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228678

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide (CID 109225773) is N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide is Cc1cccc(NC(=O)c2cncc(N3CCCC3)c2)c1.
What is the InChIKey of N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide?
The InChIKey is REZDSNFCWQZNGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-13-5-4-6-15(9-13)19-17(21)14-10-16(12-18-11-14)20-7-2-3-8-20/h4-6,9-12H,2-3,7-8H2,1H3,(H,19,21).
What are the key properties of N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide?
N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 109225773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).