[3-(imidazol-1-ylmethyl)phenyl]methanol

C11H12N2O — CID 10397593

IUPAC[3-(imidazol-1-ylmethyl)phenyl]methanol
SMILESOCc1cccc(Cn2ccnc2)c1
InChIInChI=1S/C11H12N2O/c14-8-11-3-1-2-10(6-11)7-13-5-4-12-9-13/h1-6,9,14H,7-8H2
InChIKeyTXQZIKDWFOLTSC-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.42
Rot. Bonds3

About [3-(imidazol-1-ylmethyl)phenyl]methanol

[3-(imidazol-1-ylmethyl)phenyl]methanol (PubChem CID 10397593) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is [3-(imidazol-1-ylmethyl)phenyl]methanol.

Molecular Properties

Compound Name[3-(imidazol-1-ylmethyl)phenyl]methanol
PubChem CID10397593
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name[3-(imidazol-1-ylmethyl)phenyl]methanol
SMILESOCc1cccc(Cn2ccnc2)c1
InChIInChI=1S/C11H12N2O/c14-8-11-3-1-2-10(6-11)7-13-5-4-12-9-13/h1-6,9,14H,7-8H2
InChIKeyTXQZIKDWFOLTSC-UHFFFAOYSA-N
XLogP1.42
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(imidazol-1-ylmethyl)phenyl]methanol?
The IUPAC name of [3-(imidazol-1-ylmethyl)phenyl]methanol (CID 10397593) is [3-(imidazol-1-ylmethyl)phenyl]methanol.
What is the SMILES notation for [3-(imidazol-1-ylmethyl)phenyl]methanol?
The canonical SMILES for [3-(imidazol-1-ylmethyl)phenyl]methanol is OCc1cccc(Cn2ccnc2)c1.
What is the InChIKey of [3-(imidazol-1-ylmethyl)phenyl]methanol?
The InChIKey is TXQZIKDWFOLTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c14-8-11-3-1-2-10(6-11)7-13-5-4-12-9-13/h1-6,9,14H,7-8H2.
What are the key properties of [3-(imidazol-1-ylmethyl)phenyl]methanol?
[3-(imidazol-1-ylmethyl)phenyl]methanol has a molecular weight of 188.23 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(imidazol-1-ylmethyl)phenyl]methanol is sourced from PubChem (CID 10397593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).