N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide

C19H21N3O2 — CID 109102907

IUPACN-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cncc(C(=O)N3CCCCC3)c2)c1
InChIInChI=1S/C19H21N3O2/c1-14-6-5-7-17(10-14)21-18(23)15-11-16(13-20-12-15)19(24)22-8-3-2-4-9-22/h5-7,10-13H,2-4,8-9H2,1H3,(H,21,23)
InChIKeyPIFNMDLLHURKHZ-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.27
Rot. Bonds3

About N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide

N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide (PubChem CID 109102907) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
PubChem CID109102907
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cncc(C(=O)N3CCCCC3)c2)c1
InChIInChI=1S/C19H21N3O2/c1-14-6-5-7-17(10-14)21-18(23)15-11-16(13-20-12-15)19(24)22-8-3-2-4-9-22/h5-7,10-13H,2-4,8-9H2,1H3,(H,21,23)
InChIKeyPIFNMDLLHURKHZ-UHFFFAOYSA-N
XLogP3.27
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylphenyl)-5-(4-methylpiperazine-1-carbonyl)pyridine-3-carboxamide
CID 109104452
N-(3,5-dimethylphenyl)-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
CID 109102567
N-(3-methoxyphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102944
N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225773
N-(4-acetamidophenyl)-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
CID 109102613
N-(4-chlorophenyl)-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
CID 109102585
N-[4-(azepane-1-carbonyl)phenyl]-3-methylbenzamide
CID 17198989
N-(2,6-diethylphenyl)-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
CID 109102577
5-hydroxy-N-(3-methylphenyl)pyridine-3-carboxamide
CID 63865627
5-(azepane-1-carbonyl)-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide
CID 109107727
N-(3-chloro-4-methoxyphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102940
N-(3-acetylphenyl)-3-(azepane-1-carbonyl)benzamide
CID 109056722

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide?
The IUPAC name of N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide (CID 109102907) is N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide?
The canonical SMILES for N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide is Cc1cccc(NC(=O)c2cncc(C(=O)N3CCCCC3)c2)c1.
What is the InChIKey of N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide?
The InChIKey is PIFNMDLLHURKHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-14-6-5-7-17(10-14)21-18(23)15-11-16(13-20-12-15)19(24)22-8-3-2-4-9-22/h5-7,10-13H,2-4,8-9H2,1H3,(H,21,23).
What are the key properties of N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide?
N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 3.27, 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-(piperidine-1-carbonyl)pyridine-3-carboxamide is sourced from PubChem (CID 109102907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).