[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol

C9H8F5NO — CID 118829480

IUPAC[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol
SMILESCc1c(C(F)F)cc(CO)nc1C(F)(F)F
InChIInChI=1S/C9H8F5NO/c1-4-6(8(10)11)2-5(3-16)15-7(4)9(12,13)14/h2,8,16H,3H2,1H3
InChIKeySXJUZUACFLMHQF-UHFFFAOYSA-N
MW241.16 g/mol
LogP2.84
Rot. Bonds2

About [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol

[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol (PubChem CID 118829480) has the molecular formula C9H8F5NO and a molecular weight of 241.16 g/mol. Its IUPAC name is [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol
PubChem CID118829480
Molecular FormulaC9H8F5NO
Molecular Weight241.16 g/mol
Exact Mass241.05
IUPAC Name[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol
SMILESCc1c(C(F)F)cc(CO)nc1C(F)(F)F
InChIInChI=1S/C9H8F5NO/c1-4-6(8(10)11)2-5(3-16)15-7(4)9(12,13)14/h2,8,16H,3H2,1H3
InChIKeySXJUZUACFLMHQF-UHFFFAOYSA-N
XLogP2.84
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.16
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(difluoromethyl)-6-(hydroxymethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile
CID 133106992
[6-(aminomethyl)-4-(difluoromethyl)-5-methyl-2-pyridinyl]methanol
CID 130088446
[4-(difluoromethyl)-6-methoxy-5-methyl-2-pyridinyl]methanol
CID 118806611
4-(difluoromethyl)-6-(hydroxymethyl)-3-methylpyridine-2-carbonitrile
CID 118991281
4-(difluoromethyl)-6-(hydroxymethyl)-2-methylpyridin-3-ol
CID 118834562
[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 118839527
[4-(difluoromethyl)-6-methoxy-5-(trifluoromethyl)-2-pyridinyl]methanol
CID 118851695
[4-(difluoromethyl)-5-iodo-6-methyl-2-pyridinyl]methanol
CID 118800735
[4-(difluoromethyl)-5-fluoro-6-methoxy-2-pyridinyl]methanol
CID 118846106
[5,6-dibromo-4-(difluoromethyl)-2-pyridinyl]methanol
CID 118803957
6-(bromomethyl)-4-(difluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine
CID 130086999
[4-(difluoromethyl)-6-methyl-2-(trifluoromethyl)-3-pyridinyl]methanamine
CID 130088386

Frequently Asked Questions

What is the IUPAC name of [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol?
The IUPAC name of [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol (CID 118829480) is [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol.
What is the SMILES notation for [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol?
The canonical SMILES for [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol is Cc1c(C(F)F)cc(CO)nc1C(F)(F)F.
What is the InChIKey of [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol?
The InChIKey is SXJUZUACFLMHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F5NO/c1-4-6(8(10)11)2-5(3-16)15-7(4)9(12,13)14/h2,8,16H,3H2,1H3.
What are the key properties of [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol?
[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol has a molecular weight of 241.16 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol is sourced from PubChem (CID 118829480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).