4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol

C7H6ClF2NO — CID 130072333

IUPAC4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol
SMILESCc1c(C(F)F)ncc(O)c1Cl
InChIInChI=1S/C7H6ClF2NO/c1-3-5(8)4(12)2-11-6(3)7(9)10/h2,7,12H,1H3
InChIKeyJIEZWDQMXMMHPG-UHFFFAOYSA-N
MW193.58 g/mol
LogP2.69
Rot. Bonds1

About 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol

4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol (PubChem CID 130072333) has the molecular formula C7H6ClF2NO and a molecular weight of 193.58 g/mol. Its IUPAC name is 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol.

Molecular Properties

Compound Name4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol
PubChem CID130072333
Molecular FormulaC7H6ClF2NO
Molecular Weight193.58 g/mol
Exact Mass193.01
IUPAC Name4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol
SMILESCc1c(C(F)F)ncc(O)c1Cl
InChIInChI=1S/C7H6ClF2NO/c1-3-5(8)4(12)2-11-6(3)7(9)10/h2,7,12H,1H3
InChIKeyJIEZWDQMXMMHPG-UHFFFAOYSA-N
XLogP2.69
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.58
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol?
The IUPAC name of 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol (CID 130072333) is 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol.
What is the SMILES notation for 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol?
The canonical SMILES for 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol is Cc1c(C(F)F)ncc(O)c1Cl.
What is the InChIKey of 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol?
The InChIKey is JIEZWDQMXMMHPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClF2NO/c1-3-5(8)4(12)2-11-6(3)7(9)10/h2,7,12H,1H3.
What are the key properties of 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol?
4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol has a molecular weight of 193.58 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(difluoromethyl)-5-methylpyridin-3-ol is sourced from PubChem (CID 130072333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).