2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide

C13H11ClFN3O — CID 62151947

IUPAC2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide
SMILESCc1ccc(NC(=O)c2cc(N)nc(Cl)c2)c(F)c1
InChIInChI=1S/C13H11ClFN3O/c1-7-2-3-10(9(15)4-7)17-13(19)8-5-11(14)18-12(16)6-8/h2-6H,1H3,(H2,16,18)(H,17,19)
InChIKeyNHJGLNWNDXPERP-UHFFFAOYSA-N
MW279.70 g/mol
LogP3.02
Rot. Bonds2

About 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide

2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide (PubChem CID 62151947) has the molecular formula C13H11ClFN3O and a molecular weight of 279.70 g/mol. Its IUPAC name is 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide
PubChem CID62151947
Molecular FormulaC13H11ClFN3O
Molecular Weight279.70 g/mol
Exact Mass279.06
IUPAC Name2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide
SMILESCc1ccc(NC(=O)c2cc(N)nc(Cl)c2)c(F)c1
InChIInChI=1S/C13H11ClFN3O/c1-7-2-3-10(9(15)4-7)17-13(19)8-5-11(14)18-12(16)6-8/h2-6H,1H3,(H2,16,18)(H,17,19)
InChIKeyNHJGLNWNDXPERP-UHFFFAOYSA-N
XLogP3.02
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.70
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-amino-6-chloro-N-(2,5-difluoro-4-methylphenyl)pyridine-4-carboxamide
CID 103587247
2-amino-6-chloro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 62156439
2,6-dichloro-N-(2,4-difluorophenyl)pyridine-4-carboxamide
CID 26722050
2-amino-6-chloro-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide
CID 62872287
3-chloro-N-(2-fluoro-4-methylphenyl)-4-hydroxybenzamide
CID 28881729
2-amino-N-(5-bromo-2-methylphenyl)-6-chloropyridine-4-carboxamide
CID 62159768
2-amino-N-(2-bromo-5-chlorophenyl)-6-chloropyridine-4-carboxamide
CID 81275531
2-amino-6-chloro-N-(2-iodophenyl)pyridine-4-carboxamide
CID 62154227
N-(4-amino-2-fluorophenyl)-3-chloro-5-methylbenzamide
CID 81326271
3-amino-4-bromo-N-(2-fluoro-4-methylphenyl)benzamide
CID 61093746
3-bromo-4-chloro-N-(2-fluoro-4-methylphenyl)benzamide
CID 103841501
4-fluoro-N-(2-fluoro-4-methylphenyl)-3-methylbenzamide
CID 55163065

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide (CID 62151947) is 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide is Cc1ccc(NC(=O)c2cc(N)nc(Cl)c2)c(F)c1.
What is the InChIKey of 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide?
The InChIKey is NHJGLNWNDXPERP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFN3O/c1-7-2-3-10(9(15)4-7)17-13(19)8-5-11(14)18-12(16)6-8/h2-6H,1H3,(H2,16,18)(H,17,19).
What are the key properties of 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide?
2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide has a molecular weight of 279.70 g/mol, XLogP of 3.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 62151947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).