[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol

C11H12N2O2 — CID 54847133

IUPAC[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol
SMILESCOc1ccccc1-c1cc(CO)[nH]n1
InChIInChI=1S/C11H12N2O2/c1-15-11-5-3-2-4-9(11)10-6-8(7-14)12-13-10/h2-6,14H,7H2,1H3,(H,12,13)
InChIKeyIXIODNUPYPVUBO-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.58
Rot. Bonds3

About [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol

[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol (PubChem CID 54847133) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol.

Molecular Properties

Compound Name[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol
PubChem CID54847133
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol
SMILESCOc1ccccc1-c1cc(CO)[nH]n1
InChIInChI=1S/C11H12N2O2/c1-15-11-5-3-2-4-9(11)10-6-8(7-14)12-13-10/h2-6,14H,7H2,1H3,(H,12,13)
InChIKeyIXIODNUPYPVUBO-UHFFFAOYSA-N
XLogP1.58
TPSA58.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol?
The IUPAC name of [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol (CID 54847133) is [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol.
What is the SMILES notation for [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol?
The canonical SMILES for [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol is COc1ccccc1-c1cc(CO)[nH]n1.
What is the InChIKey of [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol?
The InChIKey is IXIODNUPYPVUBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-15-11-5-3-2-4-9(11)10-6-8(7-14)12-13-10/h2-6,14H,7H2,1H3,(H,12,13).
What are the key properties of [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol?
[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol has a molecular weight of 204.23 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]methanol is sourced from PubChem (CID 54847133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).