4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate

C8H7F2N2O3- — CID 152778193

IUPAC4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate
SMILESCOc1c(N)cc(C(F)F)nc1C(=O)[O-]
InChIInChI=1S/C8H8F2N2O3/c1-15-6-3(11)2-4(7(9)10)12-5(6)8(13)14/h2,7H,1H3,(H2,11,12)(H,13,14)/p-1
InChIKeyDLFRSVWJNJNMJM-UHFFFAOYSA-M
MW217.15 g/mol
LogP-0.03
Rot. Bonds3

About 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate

4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate (PubChem CID 152778193) has the molecular formula C8H7F2N2O3- and a molecular weight of 217.15 g/mol. Its IUPAC name is 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate.

Molecular Properties

Compound Name4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate
PubChem CID152778193
Molecular FormulaC8H7F2N2O3-
Molecular Weight217.15 g/mol
Exact Mass217.04
IUPAC Name4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate
SMILESCOc1c(N)cc(C(F)F)nc1C(=O)[O-]
InChIInChI=1S/C8H8F2N2O3/c1-15-6-3(11)2-4(7(9)10)12-5(6)8(13)14/h2,7H,1H3,(H2,11,12)(H,13,14)/p-1
InChIKeyDLFRSVWJNJNMJM-UHFFFAOYSA-M
XLogP-0.03
TPSA88.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.15
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate 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

methyl 4-amino-6-(difluoromethyl)-3-hydroxypyridine-2-carboxylate
CID 130104973
2-(bromomethyl)-6-(difluoromethyl)-3-methoxypyridin-4-amine
CID 130105942
6-(difluoromethyl)-4-fluoro-3-methoxypyridine-2-carboxylic acid
CID 130080785
4-amino-6-(difluoromethyl)-3-methylpyridine-2-carboxamide
CID 118823020
6-(difluoromethyl)-3-methoxy-4-methylpyridine-2-carbonyl chloride
CID 133099514
4-amino-6-(difluoromethyl)-2-methoxypyridine-3-carboxylic acid
CID 118845538
ethyl 6-(difluoromethyl)-3-methoxy-4-methylpyridine-2-carboxylate
CID 133100411
2-chloro-6-(difluoromethyl)-3-methoxypyridine-4-carboxylic acid
CID 119002941
ethyl 4-amino-3-bromo-6-(difluoromethyl)pyridine-2-carboxylate
CID 134669270
methyl 3-amino-6-(difluoromethyl)-4-(trifluoromethyl)pyridine-2-carboxylate
CID 134684128
4-amino-3-cyano-6-(difluoromethyl)pyridine-2-carboxylic acid
CID 118829125
4-amino-6-(difluoromethyl)-5-methoxypyridine-2-carboxamide
CID 118801026

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate?
The IUPAC name of 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate (CID 152778193) is 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate.
What is the SMILES notation for 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate?
The canonical SMILES for 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate is COc1c(N)cc(C(F)F)nc1C(=O)[O-].
What is the InChIKey of 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate?
The InChIKey is DLFRSVWJNJNMJM-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H8F2N2O3/c1-15-6-3(11)2-4(7(9)10)12-5(6)8(13)14/h2,7H,1H3,(H2,11,12)(H,13,14)/p-1.
What are the key properties of 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate?
4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate has a molecular weight of 217.15 g/mol, XLogP of -0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate is sourced from PubChem (CID 152778193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).