N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide

C20H19N3O — CID 110683644

IUPACN-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
SMILESCN(CCc1ccncc1)C(=O)c1ccc(-c2ccccc2)nc1
InChIInChI=1S/C20H19N3O/c1-23(14-11-16-9-12-21-13-10-16)20(24)18-7-8-19(22-15-18)17-5-3-2-4-6-17/h2-10,12-13,15H,11,14H2,1H3
InChIKeyIKKJWDGTULAYNW-UHFFFAOYSA-N
MW317.39 g/mol
LogP3.46
Rot. Bonds5

About N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide

N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide (PubChem CID 110683644) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
PubChem CID110683644
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC NameN-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
SMILESCN(CCc1ccncc1)C(=O)c1ccc(-c2ccccc2)nc1
InChIInChI=1S/C20H19N3O/c1-23(14-11-16-9-12-21-13-10-16)20(24)18-7-8-19(22-15-18)17-5-3-2-4-6-17/h2-10,12-13,15H,11,14H2,1H3
InChIKeyIKKJWDGTULAYNW-UHFFFAOYSA-N
XLogP3.46
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-6-(2-phenylethylamino)-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109158205
N-methyl-2-(2-methylpropylamino)-N-(2-pyridin-4-ylethyl)pyrimidine-5-carboxamide
CID 109248668
N-methyl-6-(propylamino)-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109151190
6-[(4-fluorophenyl)methylamino]-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109156607
2-[(2-fluorophenyl)methylamino]-N-methyl-N-(2-pyridin-4-ylethyl)pyrimidine-5-carboxamide
CID 109257019
2-[(2-chlorophenyl)methylamino]-N-methyl-N-(2-pyridin-4-ylethyl)pyrimidine-5-carboxamide
CID 109257493
1-N-butyl-1-N,4-N-dimethyl-4-N-(2-pyridin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109048088
N-methyl-2-oxo-N-(2-pyridin-4-ylethyl)-1,3-dihydrobenzimidazole-5-carboxamide
CID 110692316
N-methyl-4-(2-methylpropoxy)-N-(2-pyridin-4-ylethyl)benzamide
CID 110440864
N-methyl-4-propan-2-yloxy-N-(2-pyridin-4-ylethyl)benzamide
CID 110762446
2-(2-methoxyethylamino)-N-methyl-N-(2-pyridin-4-ylethyl)pyrimidine-5-carboxamide
CID 109251520
4-(3-methoxyphenyl)-N-methyl-N-(2-pyridin-4-ylethyl)benzamide
CID 77093047

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide?
The IUPAC name of N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide (CID 110683644) is N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide is CN(CCc1ccncc1)C(=O)c1ccc(-c2ccccc2)nc1.
What is the InChIKey of N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide?
The InChIKey is IKKJWDGTULAYNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c1-23(14-11-16-9-12-21-13-10-16)20(24)18-7-8-19(22-15-18)17-5-3-2-4-6-17/h2-10,12-13,15H,11,14H2,1H3.
What are the key properties of N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide?
N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 3.46, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-phenyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 110683644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).