3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile

C7H3ClF2N2O — CID 130070938

IUPAC3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile
SMILESN#Cc1c(O)cnc(C(F)F)c1Cl
InChIInChI=1S/C7H3ClF2N2O/c8-5-3(1-11)4(13)2-12-6(5)7(9)10/h2,7,13H
InChIKeyDCFGNALIMPFJGO-UHFFFAOYSA-N
MW204.56 g/mol
LogP2.25
Rot. Bonds1

About 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile

3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile (PubChem CID 130070938) has the molecular formula C7H3ClF2N2O and a molecular weight of 204.56 g/mol. Its IUPAC name is 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile.

Molecular Properties

Compound Name3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile
PubChem CID130070938
Molecular FormulaC7H3ClF2N2O
Molecular Weight204.56 g/mol
Exact Mass203.99
IUPAC Name3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile
SMILESN#Cc1c(O)cnc(C(F)F)c1Cl
InChIInChI=1S/C7H3ClF2N2O/c8-5-3(1-11)4(13)2-12-6(5)7(9)10/h2,7,13H
InChIKeyDCFGNALIMPFJGO-UHFFFAOYSA-N
XLogP2.25
TPSA56.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.56
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile 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

5-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine-4-carbonitrile
CID 130071152
2-[3-chloro-2-(difluoromethyl)-5-hydroxy-4-pyridinyl]acetonitrile
CID 130072557
2-(difluoromethyl)-4-formyl-5-hydroxypyridine-3-carbonitrile
CID 130076837
4-chloro-5-(chloromethyl)-2-(difluoromethyl)pyridine-3-carbonitrile
CID 130071207
ethyl 5-chloro-4-cyano-6-(difluoromethyl)pyridine-3-carboxylate
CID 134674110
5-chloro-2-(difluoromethyl)-3-(hydroxymethyl)pyridine-4-carbonitrile
CID 130071262
4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol
CID 130072333
2-[4,5-dichloro-6-(difluoromethyl)-3-pyridinyl]acetonitrile
CID 130099368
5-chloro-6-(difluoromethyl)-4-nitropyridin-3-ol
CID 130072355
3-(aminomethyl)-5-chloro-2-(difluoromethyl)pyridine-4-carbonitrile
CID 130071103
4-bromo-5-cyano-6-(difluoromethyl)pyridine-3-carboxylic acid
CID 130109044
[5-chloro-6-(difluoromethyl)-4-fluoro-3-pyridinyl]methanol
CID 130071902

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile?
The IUPAC name of 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile (CID 130070938) is 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile.
What is the SMILES notation for 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile?
The canonical SMILES for 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile is N#Cc1c(O)cnc(C(F)F)c1Cl.
What is the InChIKey of 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile?
The InChIKey is DCFGNALIMPFJGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3ClF2N2O/c8-5-3(1-11)4(13)2-12-6(5)7(9)10/h2,7,13H.
What are the key properties of 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile?
3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile has a molecular weight of 204.56 g/mol, XLogP of 2.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(difluoromethyl)-5-hydroxypyridine-4-carbonitrile is sourced from PubChem (CID 130070938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).