(2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol

C11H11FN2O — CID 61088379

IUPAC(2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol
SMILESCn1cc(C(O)c2ccccc2F)cn1
InChIInChI=1S/C11H11FN2O/c1-14-7-8(6-13-14)11(15)9-4-2-3-5-10(9)12/h2-7,11,15H,1H3
InChIKeyZTHSJMWOJUMWJW-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.64
Rot. Bonds2

About (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol

(2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol (PubChem CID 61088379) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name(2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol
PubChem CID61088379
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name(2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol
SMILESCn1cc(C(O)c2ccccc2F)cn1
InChIInChI=1S/C11H11FN2O/c1-14-7-8(6-13-14)11(15)9-4-2-3-5-10(9)12/h2-7,11,15H,1H3
InChIKeyZTHSJMWOJUMWJW-UHFFFAOYSA-N
XLogP1.64
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromo-2-chlorophenyl)-(1-methylpyrazol-4-yl)methanol
CID 114981782
(4-chlorophenyl)-(1-methylpyrazol-4-yl)methanol
CID 61088026
(4-chloro-3-fluorophenyl)-(1-methylpyrazol-4-yl)methanol
CID 63895357
1-(2-fluorophenyl)-2-[(1-methylpyrazol-4-yl)amino]ethanol
CID 79769940
bis(2-fluorophenyl)methanol
CID 18424663
(2,3-difluorophenyl)-(1-phenylpyrazol-4-yl)methanol
CID 62662141
(4-bromo-1-methylpyrazol-5-yl)-(2-fluorophenyl)methanol
CID 114634713
(2,4-dibromophenyl)-(1-methylpyrazol-4-yl)methanol
CID 107947298
(S)-(2-fluorophenyl)-pyridin-4-ylmethanol
CID 166771520
(3-tert-butyl-1-methylpyrazol-4-yl)-(2-fluorophenyl)methanol
CID 83090575
[2-fluoro-3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]phenyl]-(1-methylpyrazol-4-yl)methanol
CID 175183546
(2-bromo-3-fluorophenyl)-(1-phenylpyrazol-4-yl)methanol
CID 81499833

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol?
The IUPAC name of (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol (CID 61088379) is (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol.
What is the SMILES notation for (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol?
The canonical SMILES for (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol is Cn1cc(C(O)c2ccccc2F)cn1.
What is the InChIKey of (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol?
The InChIKey is ZTHSJMWOJUMWJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-14-7-8(6-13-14)11(15)9-4-2-3-5-10(9)12/h2-7,11,15H,1H3.
What are the key properties of (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol?
(2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol has a molecular weight of 206.22 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol is sourced from PubChem (CID 61088379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).