N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride

C13H12ClFN2O — CID 110776367

IUPACN-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride
SMILESCc1cc(NC(=O)c2ccncc2)ccc1F.Cl
InChIInChI=1S/C13H11FN2O.ClH/c1-9-8-11(2-3-12(9)14)16-13(17)10-4-6-15-7-5-10;/h2-8H,1H3,(H,16,17);1H
InChIKeyHYCSIOKGSUEGTC-UHFFFAOYSA-N
MW266.70 g/mol
LogP3.20
Rot. Bonds2

About N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride

N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride (PubChem CID 110776367) has the molecular formula C13H12ClFN2O and a molecular weight of 266.70 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride
PubChem CID110776367
Molecular FormulaC13H12ClFN2O
Molecular Weight266.70 g/mol
Exact Mass266.06
IUPAC NameN-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride
SMILESCc1cc(NC(=O)c2ccncc2)ccc1F.Cl
InChIInChI=1S/C13H11FN2O.ClH/c1-9-8-11(2-3-12(9)14)16-13(17)10-4-6-15-7-5-10;/h2-8H,1H3,(H,16,17);1H
InChIKeyHYCSIOKGSUEGTC-UHFFFAOYSA-N
XLogP3.20
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.70
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide
CID 103755165
N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide
CID 104938981
N-(3-chloro-4-methylphenyl)pyridine-4-carboxamide;hydrochloride
CID 110756427
N-(3-fluoro-4-hydroxyphenyl)pyridine-4-carboxamide
CID 64780099
N-(4-chloro-3-fluorophenyl)pyridine-4-carboxamide
CID 47228006
3-[(4-fluoro-3-methylphenyl)carbamoyl]benzoic acid
CID 62812413
4-(dimethylsulfamoyl)-N-(4-fluoro-3-methylphenyl)benzamide
CID 110776363
methanol;N-pyridin-4-ylpyridine-4-carboxamide
CID 158472241
3-amino-4-bromo-N-(4-fluoro-3-methylphenyl)benzamide
CID 55118828
N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide
CID 104628285
5-bromo-N-(4-fluoro-3-methylphenyl)thiophene-3-carboxamide
CID 62812532
(4-fluoro-3-methylphenyl)-pyridin-4-ylmethanone
CID 62789749

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride?
The IUPAC name of N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride (CID 110776367) is N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride is Cc1cc(NC(=O)c2ccncc2)ccc1F.Cl.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride?
The InChIKey is HYCSIOKGSUEGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O.ClH/c1-9-8-11(2-3-12(9)14)16-13(17)10-4-6-15-7-5-10;/h2-8H,1H3,(H,16,17);1H.
What are the key properties of N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride?
N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride has a molecular weight of 266.70 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride is sourced from PubChem (CID 110776367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).