[4-(1-methylimidazol-4-yl)phenyl]methanol

C11H12N2O — CID 142503697

IUPAC[4-(1-methylimidazol-4-yl)phenyl]methanol
SMILESCn1cnc(-c2ccc(CO)cc2)c1
InChIInChI=1S/C11H12N2O/c1-13-6-11(12-8-13)10-4-2-9(7-14)3-5-10/h2-6,8,14H,7H2,1H3
InChIKeyUQMHBLBACSTFKF-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.58
Rot. Bonds2

About [4-(1-methylimidazol-4-yl)phenyl]methanol

[4-(1-methylimidazol-4-yl)phenyl]methanol (PubChem CID 142503697) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is [4-(1-methylimidazol-4-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-(1-methylimidazol-4-yl)phenyl]methanol
PubChem CID142503697
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name[4-(1-methylimidazol-4-yl)phenyl]methanol
SMILESCn1cnc(-c2ccc(CO)cc2)c1
InChIInChI=1S/C11H12N2O/c1-13-6-11(12-8-13)10-4-2-9(7-14)3-5-10/h2-6,8,14H,7H2,1H3
InChIKeyUQMHBLBACSTFKF-UHFFFAOYSA-N
XLogP1.58
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(1-methylimidazol-4-yl)phenyl]methanol?
The IUPAC name of [4-(1-methylimidazol-4-yl)phenyl]methanol (CID 142503697) is [4-(1-methylimidazol-4-yl)phenyl]methanol.
What is the SMILES notation for [4-(1-methylimidazol-4-yl)phenyl]methanol?
The canonical SMILES for [4-(1-methylimidazol-4-yl)phenyl]methanol is Cn1cnc(-c2ccc(CO)cc2)c1.
What is the InChIKey of [4-(1-methylimidazol-4-yl)phenyl]methanol?
The InChIKey is UQMHBLBACSTFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-13-6-11(12-8-13)10-4-2-9(7-14)3-5-10/h2-6,8,14H,7H2,1H3.
What are the key properties of [4-(1-methylimidazol-4-yl)phenyl]methanol?
[4-(1-methylimidazol-4-yl)phenyl]methanol has a molecular weight of 188.23 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-methylimidazol-4-yl)phenyl]methanol is sourced from PubChem (CID 142503697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).