2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide

C14H14FN3O — CID 105384537

IUPAC2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide
SMILESCCc1ccc(NC(=O)c2ccnc(N)c2F)cc1
InChIInChI=1S/C14H14FN3O/c1-2-9-3-5-10(6-4-9)18-14(19)11-7-8-17-13(16)12(11)15/h3-8H,2H2,1H3,(H2,16,17)(H,18,19)
InChIKeyRNSHNLJTOCUISL-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.62
Rot. Bonds3

About 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide

2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide (PubChem CID 105384537) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide
PubChem CID105384537
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC Name2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide
SMILESCCc1ccc(NC(=O)c2ccnc(N)c2F)cc1
InChIInChI=1S/C14H14FN3O/c1-2-9-3-5-10(6-4-9)18-14(19)11-7-8-17-13(16)12(11)15/h3-8H,2H2,1H3,(H2,16,17)(H,18,19)
InChIKeyRNSHNLJTOCUISL-UHFFFAOYSA-N
XLogP2.62
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide
CID 105384043
2-amino-N-(3-bromo-4-fluorophenyl)-3-fluoropyridine-4-carboxamide
CID 105387341
2-amino-N-(4-bromo-3-methylphenyl)-3-fluoropyridine-4-carboxamide
CID 105384093
2-amino-N-(4-ethylphenyl)-4-fluorobenzamide
CID 63109707
2-amino-3-fluoro-N-[3-(3-hydroxypropyl)phenyl]pyridine-4-carboxamide
CID 105387248
2-amino-3-fluoro-N-(2-methylbutan-2-yl)pyridine-4-carboxamide
CID 105384278
2-amino-3-fluoro-N-(4-fluoro-2-methylphenyl)pyridine-4-carboxamide
CID 105384562
2-amino-N-(2-ethoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 105384040
2-amino-N-(2,6-difluorophenyl)-3-fluoropyridine-4-carboxamide
CID 105384666
2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide
CID 26697286
2-amino-3-fluoro-N-pyridin-2-ylpyridine-4-carboxamide
CID 105384358
2-amino-N-(3-ethylpentan-2-yl)-3-fluoropyridine-4-carboxamide
CID 105386392

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide (CID 105384537) is 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide is CCc1ccc(NC(=O)c2ccnc(N)c2F)cc1.
What is the InChIKey of 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide?
The InChIKey is RNSHNLJTOCUISL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-2-9-3-5-10(6-4-9)18-14(19)11-7-8-17-13(16)12(11)15/h3-8H,2H2,1H3,(H2,16,17)(H,18,19).
What are the key properties of 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide?
2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide has a molecular weight of 259.28 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide is sourced from PubChem (CID 105384537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).