6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide

C13H11ClFN3O — CID 62811763

IUPAC6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cnc(N)c(Cl)c2)ccc1F
InChIInChI=1S/C13H11ClFN3O/c1-7-4-9(2-3-11(7)15)18-13(19)8-5-10(14)12(16)17-6-8/h2-6H,1H3,(H2,16,17)(H,18,19)
InChIKeyWJIOYBDBLOFOJF-UHFFFAOYSA-N
MW279.70 g/mol
LogP3.02
Rot. Bonds2

About 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide

6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide (PubChem CID 62811763) has the molecular formula C13H11ClFN3O and a molecular weight of 279.70 g/mol. Its IUPAC name is 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide
PubChem CID62811763
Molecular FormulaC13H11ClFN3O
Molecular Weight279.70 g/mol
Exact Mass279.06
IUPAC Name6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cnc(N)c(Cl)c2)ccc1F
InChIInChI=1S/C13H11ClFN3O/c1-7-4-9(2-3-11(7)15)18-13(19)8-5-10(14)12(16)17-6-8/h2-6H,1H3,(H2,16,17)(H,18,19)
InChIKeyWJIOYBDBLOFOJF-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

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Related Compounds

6-amino-5-chloro-N-(4-methylphenyl)pyridine-3-carboxamide
CID 62154043
6-amino-5-chloro-N-(4-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 62156604
6-amino-N-(3-bromophenyl)-5-chloropyridine-3-carboxamide
CID 62154024
5-amino-N-(4-fluoro-3-methylphenyl)-2-methylpyridine-3-carboxamide
CID 62811391
6-amino-5-chloro-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-3-carboxamide
CID 166216580
N-(4-fluoro-3-methylphenyl)-5-methylpyridine-2-carboxamide
CID 90289728
N-(6-chloro-3-pyridinyl)-4-fluoro-3-methylbenzamide
CID 78929782
N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride
CID 110776367
N-(3-chloro-4-fluorophenyl)-4-fluoro-3-methylbenzamide;formaldehyde
CID 144890602
3-amino-4-bromo-N-(4-fluoro-3-methylphenyl)benzamide
CID 55118828
N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide
CID 104938981
5-(aminomethyl)-N-(4-fluoro-3-methylphenyl)pyridine-2-carboxamide
CID 63722889

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide (CID 62811763) is 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide is Cc1cc(NC(=O)c2cnc(N)c(Cl)c2)ccc1F.
What is the InChIKey of 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide?
The InChIKey is WJIOYBDBLOFOJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFN3O/c1-7-4-9(2-3-11(7)15)18-13(19)8-5-10(14)12(16)17-6-8/h2-6H,1H3,(H2,16,17)(H,18,19).
What are the key properties of 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide?
6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-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 6-amino-5-chloro-N-(4-fluoro-3-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 62811763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).