[1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol

C11H10F3N3O — CID 66437687

IUPAC[1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol
SMILESCc1ccnc(-n2ncc(CO)c2C(F)(F)F)c1
InChIInChI=1S/C11H10F3N3O/c1-7-2-3-15-9(4-7)17-10(11(12,13)14)8(6-18)5-16-17/h2-5,18H,6H2,1H3
InChIKeyWJANJSLTXLUJOW-UHFFFAOYSA-N
MW257.21 g/mol
LogP2.09
Rot. Bonds2

About [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol

[1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol (PubChem CID 66437687) has the molecular formula C11H10F3N3O and a molecular weight of 257.21 g/mol. Its IUPAC name is [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol
PubChem CID66437687
Molecular FormulaC11H10F3N3O
Molecular Weight257.21 g/mol
Exact Mass257.08
IUPAC Name[1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol
SMILESCc1ccnc(-n2ncc(CO)c2C(F)(F)F)c1
InChIInChI=1S/C11H10F3N3O/c1-7-2-3-15-9(4-7)17-10(11(12,13)14)8(6-18)5-16-17/h2-5,18H,6H2,1H3
InChIKeyWJANJSLTXLUJOW-UHFFFAOYSA-N
XLogP2.09
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.21
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol?
The IUPAC name of [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol (CID 66437687) is [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol.
What is the SMILES notation for [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol?
The canonical SMILES for [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol is Cc1ccnc(-n2ncc(CO)c2C(F)(F)F)c1.
What is the InChIKey of [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol?
The InChIKey is WJANJSLTXLUJOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3O/c1-7-2-3-15-9(4-7)17-10(11(12,13)14)8(6-18)5-16-17/h2-5,18H,6H2,1H3.
What are the key properties of [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol?
[1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol has a molecular weight of 257.21 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]methanol is sourced from PubChem (CID 66437687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).