6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide

C22H22FN3O — CID 109155884

IUPAC6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide
SMILESCc1cccc(CNC(=O)c2ccc(NCCc3ccccc3F)nc2)c1
InChIInChI=1S/C22H22FN3O/c1-16-5-4-6-17(13-16)14-26-22(27)19-9-10-21(25-15-19)24-12-11-18-7-2-3-8-20(18)23/h2-10,13,15H,11-12,14H2,1H3,(H,24,25)(H,26,27)
InChIKeyZGFJZCIVKVMURQ-UHFFFAOYSA-N
MW363.44 g/mol
LogP4.11
Rot. Bonds7

About 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide

6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide (PubChem CID 109155884) has the molecular formula C22H22FN3O and a molecular weight of 363.44 g/mol. Its IUPAC name is 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide
PubChem CID109155884
Molecular FormulaC22H22FN3O
Molecular Weight363.44 g/mol
Exact Mass363.17
IUPAC Name6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide
SMILESCc1cccc(CNC(=O)c2ccc(NCCc3ccccc3F)nc2)c1
InChIInChI=1S/C22H22FN3O/c1-16-5-4-6-17(13-16)14-26-22(27)19-9-10-21(25-15-19)24-12-11-18-7-2-3-8-20(18)23/h2-10,13,15H,11-12,14H2,1H3,(H,24,25)(H,26,27)
InChIKeyZGFJZCIVKVMURQ-UHFFFAOYSA-N
XLogP4.11
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyrimidine-5-carboxamide
CID 109255820
N-[(3-methylphenyl)methyl]-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109155882
6-[2-(2-fluorophenyl)ethylamino]-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109157138
N-[(2-fluorophenyl)methyl]-2-[(3-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109255942
6-(butylamino)-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109151574
N-[(2-fluorophenyl)methyl]-6-(propylamino)pyridine-3-carboxamide
CID 62166042
N-[2-(4-methoxyphenyl)ethyl]-6-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155812
N-[2-(2-fluorophenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
CID 62171019
N-(2-fluorophenyl)-6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109158516
6-[(2-chlorophenyl)methylamino]-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109156772
N-[3-(dimethylamino)propyl]-6-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109154379
2-(2-fluorophenyl)-N-[(3-methylphenyl)methyl]acetamide
CID 38240797

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide (CID 109155884) is 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide is Cc1cccc(CNC(=O)c2ccc(NCCc3ccccc3F)nc2)c1.
What is the InChIKey of 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide?
The InChIKey is ZGFJZCIVKVMURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22FN3O/c1-16-5-4-6-17(13-16)14-26-22(27)19-9-10-21(25-15-19)24-12-11-18-7-2-3-8-20(18)23/h2-10,13,15H,11-12,14H2,1H3,(H,24,25)(H,26,27).
What are the key properties of 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide?
6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide has a molecular weight of 363.44 g/mol, XLogP of 4.11, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-fluorophenyl)ethylamino]-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 109155884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).