3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid

C7H5ClFNO2 — CID 142574349

IUPAC3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid
SMILESCc1nc(C(=O)O)c(Cl)cc1F
InChIInChI=1S/C7H5ClFNO2/c1-3-5(9)2-4(8)6(10-3)7(11)12/h2H,1H3,(H,11,12)
InChIKeyZCZVHJUCWBBHQT-UHFFFAOYSA-N
MW189.57 g/mol
LogP1.88
Rot. Bonds1

About 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid

3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid (PubChem CID 142574349) has the molecular formula C7H5ClFNO2 and a molecular weight of 189.57 g/mol. Its IUPAC name is 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid
PubChem CID142574349
Molecular FormulaC7H5ClFNO2
Molecular Weight189.57 g/mol
Exact Mass189.00
IUPAC Name3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid
SMILESCc1nc(C(=O)O)c(Cl)cc1F
InChIInChI=1S/C7H5ClFNO2/c1-3-5(9)2-4(8)6(10-3)7(11)12/h2H,1H3,(H,11,12)
InChIKeyZCZVHJUCWBBHQT-UHFFFAOYSA-N
XLogP1.88
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.57
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid 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-chloro-6-(4-chlorophenyl)-5-fluoropyridine-2-carboxylic acid
CID 141310101
3-chloro-6-(difluoromethyl)-5-fluoropyridine-2-carboxylic acid
CID 130072000
3-chloro-5-methoxycarbonyl-6-methylpyridine-2-carboxylic acid
CID 162377384
3-fluoro-5-methoxycarbonyl-6-methylpyridine-2-carboxylic acid
CID 162377368
5-chloro-2-(3-fluoro-4-methylphenyl)pyrimidine-4-carboxylic acid
CID 106511978
3,6-dimethylpyrazine-2,5-dicarboxylic acid;dihydrochloride
CID 70617975
3-(4-chlorobenzoyl)-5,6-dimethylpyridine-2-carboxylic acid
CID 168886977
2-(3-chloro-4-fluorophenyl)-5-methyl-1H-imidazole-4-carboxylic acid
CID 62532949
3-fluoro-6-(2,4,6-trichlorophenyl)pyridine-2-carboxylic acid
CID 133090327
1-(5-fluoro-2,6-dimethyl-3-pyridinyl)ethanone
CID 144835745
3-chloro-6-(2,3,5,6-tetrafluoroanilino)pyridine-2-carboxylic acid
CID 107645085
5-amino-1-(3-chloro-4-fluorophenyl)-4-methylpyrazole-3-carboxylic acid
CID 82590028

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid?
The IUPAC name of 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid (CID 142574349) is 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid.
What is the SMILES notation for 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid?
The canonical SMILES for 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid is Cc1nc(C(=O)O)c(Cl)cc1F.
What is the InChIKey of 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid?
The InChIKey is ZCZVHJUCWBBHQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClFNO2/c1-3-5(9)2-4(8)6(10-3)7(11)12/h2H,1H3,(H,11,12).
What are the key properties of 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid?
3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid has a molecular weight of 189.57 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-fluoro-6-methylpyridine-2-carboxylic acid is sourced from PubChem (CID 142574349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).