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

C20H18FN3O — CID 109233450

IUPAC5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1cncc(NCc2ccccc2F)c1
InChIInChI=1S/C20H18FN3O/c1-14-6-2-5-9-19(14)24-20(25)16-10-17(13-22-11-16)23-12-15-7-3-4-8-18(15)21/h2-11,13,23H,12H2,1H3,(H,24,25)
InChIKeyLAQZCYIGFGLJET-UHFFFAOYSA-N
MW335.38 g/mol
LogP4.39
Rot. Bonds5

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

5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide (PubChem CID 109233450) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
PubChem CID109233450
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC Name5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1cncc(NCc2ccccc2F)c1
InChIInChI=1S/C20H18FN3O/c1-14-6-2-5-9-19(14)24-20(25)16-10-17(13-22-11-16)23-12-15-7-3-4-8-18(15)21/h2-11,13,23H,12H2,1H3,(H,24,25)
InChIKeyLAQZCYIGFGLJET-UHFFFAOYSA-N
XLogP4.39
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dimethylphenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233461
N-(2-tert-butylphenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233471
N-(3,5-dimethylphenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233459
5-[(2-fluorophenyl)methylamino]-N-quinolin-8-ylpyridine-3-carboxamide
CID 109233513
N-(3-fluorophenyl)-5-[(2-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109233510
3-N-[2-(2-fluorophenyl)ethyl]-5-N-(2-methylphenyl)pyridine-3,5-dicarboxamide
CID 109106318
5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109232147
5-[(2-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide
CID 109232130
N-(4-chloro-2-methylphenyl)-5-[2-(2-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109236369
methyl 3-[[5-[(2-fluorophenyl)methylamino]pyridine-3-carbonyl]amino]benzoate
CID 109233505
N-(2-methylphenyl)-5-(prop-2-enylamino)pyridine-3-carboxamide
CID 109224233
5-[(2-methylphenyl)methylamino]-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109232172

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide (CID 109233450) is 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide is Cc1ccccc1NC(=O)c1cncc(NCc2ccccc2F)c1.
What is the InChIKey of 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide?
The InChIKey is LAQZCYIGFGLJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c1-14-6-2-5-9-19(14)24-20(25)16-10-17(13-22-11-16)23-12-15-7-3-4-8-18(15)21/h2-11,13,23H,12H2,1H3,(H,24,25).
What are the key properties of 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide?
5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide has a molecular weight of 335.38 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109233450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).