4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine

C8H5ClF5NO — CID 118822584

IUPAC4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine
SMILESCc1c(Cl)cc(C(F)F)nc1OC(F)(F)F
InChIInChI=1S/C8H5ClF5NO/c1-3-4(9)2-5(6(10)11)15-7(3)16-8(12,13)14/h2,6H,1H3
InChIKeyQLNMRKPJUGSZMT-UHFFFAOYSA-N
MW261.58 g/mol
LogP3.88
Rot. Bonds2

About 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine

4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine (PubChem CID 118822584) has the molecular formula C8H5ClF5NO and a molecular weight of 261.58 g/mol. Its IUPAC name is 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine.

Molecular Properties

Compound Name4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine
PubChem CID118822584
Molecular FormulaC8H5ClF5NO
Molecular Weight261.58 g/mol
Exact Mass261.00
IUPAC Name4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine
SMILESCc1c(Cl)cc(C(F)F)nc1OC(F)(F)F
InChIInChI=1S/C8H5ClF5NO/c1-3-4(9)2-5(6(10)11)15-7(3)16-8(12,13)14/h2,6H,1H3
InChIKeyQLNMRKPJUGSZMT-UHFFFAOYSA-N
XLogP3.88
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.58
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine-4-carbonitrile
CID 118839308
6-(difluoromethyl)-3-methoxy-4-methyl-2-(trifluoromethoxy)pyridine
CID 134678577
4-(difluoromethyl)-6-iodo-3-methyl-2-(trifluoromethoxy)pyridine
CID 118851102
[6-(difluoromethyl)-3-methoxy-2-(trifluoromethoxy)-4-pyridinyl]methanol
CID 134681962
6-(difluoromethyl)-4-fluoro-2-(trifluoromethoxy)pyridine-3-carbaldehyde
CID 134662118
2-chloro-6-(difluoromethyl)-4-methoxy-3-(trifluoromethoxy)pyridine
CID 119008935
6-(difluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridine-3-carbaldehyde
CID 134679305
6-(difluoromethyl)-3-iodo-2-methyl-4-(trifluoromethoxy)pyridine
CID 130112855
4-amino-6-(difluoromethyl)-2-(trifluoromethoxy)pyridine-3-carboxylic acid
CID 118851166
ethyl 2-[3-(aminomethyl)-6-(difluoromethyl)-2-(trifluoromethoxy)-4-pyridinyl]acetate
CID 134664307
[4-chloro-6-(difluoromethyl)-2-methoxy-3-pyridinyl]methanamine
CID 130073717
4-(chloromethyl)-6-iodo-3-methyl-2-(trifluoromethoxy)pyridine
CID 130112811

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine?
The IUPAC name of 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine (CID 118822584) is 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine.
What is the SMILES notation for 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine?
The canonical SMILES for 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine is Cc1c(Cl)cc(C(F)F)nc1OC(F)(F)F.
What is the InChIKey of 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine?
The InChIKey is QLNMRKPJUGSZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClF5NO/c1-3-4(9)2-5(6(10)11)15-7(3)16-8(12,13)14/h2,6H,1H3.
What are the key properties of 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine?
4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine has a molecular weight of 261.58 g/mol, XLogP of 3.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(difluoromethyl)-3-methyl-2-(trifluoromethoxy)pyridine is sourced from PubChem (CID 118822584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).