(2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol

C11H10F3N3O — CID 102707502

IUPAC(2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCn1nccc1C(O)c1cnccc1C(F)(F)F
InChIInChI=1S/C11H10F3N3O/c1-17-9(3-5-16-17)10(18)7-6-15-4-2-8(7)11(12,13)14/h2-6,10,18H,1H3
InChIKeySLISVQVBFBRLAD-UHFFFAOYSA-N
MW257.22 g/mol
LogP1.92
Rot. Bonds2

About (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol

(2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol (PubChem CID 102707502) has the molecular formula C11H10F3N3O and a molecular weight of 257.22 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name(2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
PubChem CID102707502
Molecular FormulaC11H10F3N3O
Molecular Weight257.22 g/mol
Exact Mass257.08
IUPAC Name(2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCn1nccc1C(O)c1cnccc1C(F)(F)F
InChIInChI=1S/C11H10F3N3O/c1-17-9(3-5-16-17)10(18)7-6-15-4-2-8(7)11(12,13)14/h2-6,10,18H,1H3
InChIKeySLISVQVBFBRLAD-UHFFFAOYSA-N
XLogP1.92
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.22
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The IUPAC name of (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol (CID 102707502) is (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol.
What is the SMILES notation for (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The canonical SMILES for (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol is Cn1nccc1C(O)c1cnccc1C(F)(F)F.
What is the InChIKey of (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
The InChIKey is SLISVQVBFBRLAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3O/c1-17-9(3-5-16-17)10(18)7-6-15-4-2-8(7)11(12,13)14/h2-6,10,18H,1H3.
What are the key properties of (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol?
(2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol has a molecular weight of 257.22 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazol-3-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol is sourced from PubChem (CID 102707502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).