5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide

C15H16FN3O — CID 104640093

IUPAC5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)Nc2cc(C)ccc2F)nc1
InChIInChI=1S/C15H16FN3O/c1-3-17-11-5-7-13(18-9-11)15(20)19-14-8-10(2)4-6-12(14)16/h4-9,17H,3H2,1-2H3,(H,19,20)
InChIKeyANHUMIRQFMPLPM-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.21
Rot. Bonds4

About 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide

5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide (PubChem CID 104640093) has the molecular formula C15H16FN3O and a molecular weight of 273.31 g/mol. Its IUPAC name is 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide
PubChem CID104640093
Molecular FormulaC15H16FN3O
Molecular Weight273.31 g/mol
Exact Mass273.13
IUPAC Name5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)Nc2cc(C)ccc2F)nc1
InChIInChI=1S/C15H16FN3O/c1-3-17-11-5-7-13(18-9-11)15(20)19-14-8-10(2)4-6-12(14)16/h4-9,17H,3H2,1-2H3,(H,19,20)
InChIKeyANHUMIRQFMPLPM-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 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide (CID 104640093) is 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide is CCNc1ccc(C(=O)Nc2cc(C)ccc2F)nc1.
What is the InChIKey of 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide?
The InChIKey is ANHUMIRQFMPLPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O/c1-3-17-11-5-7-13(18-9-11)15(20)19-14-8-10(2)4-6-12(14)16/h4-9,17H,3H2,1-2H3,(H,19,20).
What are the key properties of 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide?
5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-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 5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 104640093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).