3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide

C13H12FN3O — CID 143220427

IUPAC3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide
SMILESCc1ccc(Nc2cnccc2C(N)=O)c(F)c1
InChIInChI=1S/C13H12FN3O/c1-8-2-3-11(10(14)6-8)17-12-7-16-5-4-9(12)13(15)18/h2-7,17H,1H3,(H2,15,18)
InChIKeyOULLDQDTXRMEPE-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.37
Rot. Bonds3

About 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide

3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide (PubChem CID 143220427) has the molecular formula C13H12FN3O and a molecular weight of 245.26 g/mol. Its IUPAC name is 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide
PubChem CID143220427
Molecular FormulaC13H12FN3O
Molecular Weight245.26 g/mol
Exact Mass245.10
IUPAC Name3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide
SMILESCc1ccc(Nc2cnccc2C(N)=O)c(F)c1
InChIInChI=1S/C13H12FN3O/c1-8-2-3-11(10(14)6-8)17-12-7-16-5-4-9(12)13(15)18/h2-7,17H,1H3,(H2,15,18)
InChIKeyOULLDQDTXRMEPE-UHFFFAOYSA-N
XLogP2.37
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-fluoro-4-methylanilino)pyridine-4-carbohydrazide
CID 143220406
3-(2,4-dimethylanilino)pyridine-4-carbothioamide
CID 114288096
4-fluoro-2-(2-fluoro-4-methylanilino)-3-methylbenzamide
CID 166873038
3-(2-fluoro-4-methylanilino)-N-[3-(hydroxymethyl)heptan-3-yl]pyridine-4-carboxamide
CID 143220470
[[3-(2-fluoro-4-iodoanilino)pyridine-4-carbonyl]amino]thiourea
CID 59026765
3-(2-fluoro-4-iodoanilino)-N'-(4-methylphenyl)pyridine-4-carbohydrazide
CID 11532734
4-(2-fluoro-4-methylanilino)-1-methyl-6-oxopyridine-3-carboxamide
CID 11482748
4-[(Z)-1-amino-2-hydrazinylethenyl]-N-(2-fluoro-5-methylphenyl)pyridin-3-amine
CID 167104533
ethane;3-(2-fluoro-4-methylanilino)pyridine-4-carbonitrile
CID 176938978
2-[[2-(aminosulfanylamino)-3-fluoro-4-pyridinyl]methyl]-5-(2-fluoro-4-methylanilino)pyridine-4-carboxamide
CID 166677473
4-diethylphosphanyl-N-(2-fluoro-4-methylphenyl)pyridin-3-amine
CID 169174678
4-[ethyl(methyl)phosphoryl]-N-(2-fluoro-4-methylphenyl)pyridin-3-amine
CID 169174690

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide?
The IUPAC name of 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide (CID 143220427) is 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide.
What is the SMILES notation for 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide?
The canonical SMILES for 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide is Cc1ccc(Nc2cnccc2C(N)=O)c(F)c1.
What is the InChIKey of 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide?
The InChIKey is OULLDQDTXRMEPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O/c1-8-2-3-11(10(14)6-8)17-12-7-16-5-4-9(12)13(15)18/h2-7,17H,1H3,(H2,15,18).
What are the key properties of 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide?
3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide has a molecular weight of 245.26 g/mol, XLogP of 2.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-4-methylanilino)pyridine-4-carboxamide is sourced from PubChem (CID 143220427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).