5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide

C23H25N3O — CID 109232147

IUPAC5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCc1ccccc1CNc1cncc(C(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C23H25N3O/c1-16(2)21-10-6-7-11-22(21)26-23(27)19-12-20(15-24-13-19)25-14-18-9-5-4-8-17(18)3/h4-13,15-16,25H,14H2,1-3H3,(H,26,27)
InChIKeyJQSYUBHZSCNRMO-UHFFFAOYSA-N
MW359.47 g/mol
LogP5.38
Rot. Bonds6

About 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide

5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide (PubChem CID 109232147) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
PubChem CID109232147
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC Name5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCc1ccccc1CNc1cncc(C(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C23H25N3O/c1-16(2)21-10-6-7-11-22(21)26-23(27)19-12-20(15-24-13-19)25-14-18-9-5-4-8-17(18)3/h4-13,15-16,25H,14H2,1-3H3,(H,26,27)
InChIKeyJQSYUBHZSCNRMO-UHFFFAOYSA-N
XLogP5.38
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 55.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2-methylphenyl)methylamino]-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109232172
5-[(2-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide
CID 109232130
5-[(4-chlorophenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109234113
5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109188310
5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109231540
5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109233450
5-[2-(2-methoxyphenyl)ethylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109236679
N-(3-methylphenyl)-5-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232132
N-butan-2-yl-5-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109225134
N-tert-butyl-5-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232118
N-(4-ethylphenyl)-5-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232144
N-(2,3-dimethylphenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233461

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide (CID 109232147) is 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide is Cc1ccccc1CNc1cncc(C(=O)Nc2ccccc2C(C)C)c1.
What is the InChIKey of 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The InChIKey is JQSYUBHZSCNRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-16(2)21-10-6-7-11-22(21)26-23(27)19-12-20(15-24-13-19)25-14-18-9-5-4-8-17(18)3/h4-13,15-16,25H,14H2,1-3H3,(H,26,27).
What are the key properties of 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 5.38, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109232147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).