4-chloro-5-fluoro-6-methylpyridine-3-carboxamide

C7H6ClFN2O — CID 167697175

IUPAC4-chloro-5-fluoro-6-methylpyridine-3-carboxamide
SMILESCc1ncc(C(N)=O)c(Cl)c1F
InChIInChI=1S/C7H6ClFN2O/c1-3-6(9)5(8)4(2-11-3)7(10)12/h2H,1H3,(H2,10,12)
InChIKeyXVFDOLKYHRLTIU-UHFFFAOYSA-N
MW188.59 g/mol
LogP1.28
Rot. Bonds1

About 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide

4-chloro-5-fluoro-6-methylpyridine-3-carboxamide (PubChem CID 167697175) has the molecular formula C7H6ClFN2O and a molecular weight of 188.59 g/mol. Its IUPAC name is 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-5-fluoro-6-methylpyridine-3-carboxamide
PubChem CID167697175
Molecular FormulaC7H6ClFN2O
Molecular Weight188.59 g/mol
Exact Mass188.02
IUPAC Name4-chloro-5-fluoro-6-methylpyridine-3-carboxamide
SMILESCc1ncc(C(N)=O)c(Cl)c1F
InChIInChI=1S/C7H6ClFN2O/c1-3-6(9)5(8)4(2-11-3)7(10)12/h2H,1H3,(H2,10,12)
InChIKeyXVFDOLKYHRLTIU-UHFFFAOYSA-N
XLogP1.28
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.59
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-5-(difluoromethyl)-6-fluoropyridine-3-carboxamide
CID 118833693
4-chloro-5-fluoropyridine-3-carboxamide
CID 99981298
4-chloropyridine-3,5-dicarboxamide
CID 151323477
5-(difluoromethyl)-4,6-dimethylpyridine-3-carboxamide
CID 130101517
4-chloro-1-methylpyrrolo[2,3-b]pyridine-5-carboxamide
CID 118593207
4-amino-5-(difluoromethyl)-6-methylpyridine-3-carboxamide
CID 118818070
6-amino-4-chloro-5-iodopyridine-3-carboxamide
CID 168948023
4,6-dichloroquinoline-3-carboxamide
CID 19827987
4-bromo-5-(difluoromethyl)-6-methylpyridine-3-carboxamide
CID 118844639
3-fluoro-2,4-dimethylbenzamide
CID 119006165
5-methoxy-6-methylpyridine-3,4-dicarboxamide
CID 154194091
4-(difluoromethyl)-5-fluoro-6-methylpyridine-3-carboxylic acid
CID 118828922

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide (CID 167697175) is 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide is Cc1ncc(C(N)=O)c(Cl)c1F.
What is the InChIKey of 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide?
The InChIKey is XVFDOLKYHRLTIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClFN2O/c1-3-6(9)5(8)4(2-11-3)7(10)12/h2H,1H3,(H2,10,12).
What are the key properties of 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide?
4-chloro-5-fluoro-6-methylpyridine-3-carboxamide has a molecular weight of 188.59 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-fluoro-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 167697175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).