2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide

C15H16FN3O — CID 62185386

IUPAC2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)Nc1ccc(C)cc1F
InChIInChI=1S/C15H16FN3O/c1-3-17-14-11(5-4-8-18-14)15(20)19-13-7-6-10(2)9-12(13)16/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyVUMZFMRGMATBAC-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.21
Rot. Bonds4

About 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide

2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide (PubChem CID 62185386) has the molecular formula C15H16FN3O and a molecular weight of 273.31 g/mol. Its IUPAC name is 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide
PubChem CID62185386
Molecular FormulaC15H16FN3O
Molecular Weight273.31 g/mol
Exact Mass273.13
IUPAC Name2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)Nc1ccc(C)cc1F
InChIInChI=1S/C15H16FN3O/c1-3-17-14-11(5-4-8-18-14)15(20)19-13-7-6-10(2)9-12(13)16/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyVUMZFMRGMATBAC-UHFFFAOYSA-N
XLogP3.21
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide (CID 62185386) is 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide is CCNc1ncccc1C(=O)Nc1ccc(C)cc1F.
What is the InChIKey of 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide?
The InChIKey is VUMZFMRGMATBAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O/c1-3-17-14-11(5-4-8-18-14)15(20)19-13-7-6-10(2)9-12(13)16/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide?
2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide has a molecular weight of 273.31 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 62185386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).