bis(1-methylimidazol-2-yl)-phenylmethanol

C15H16N4O — CID 2849523

IUPACbis(1-methylimidazol-2-yl)-phenylmethanol
SMILESCn1ccnc1C(O)(c1ccccc1)c1nccn1C
InChIInChI=1S/C15H16N4O/c1-18-10-8-16-13(18)15(20,12-6-4-3-5-7-12)14-17-9-11-19(14)2/h3-11,20H,1-2H3
InChIKeyNWIYARUDRHTEHU-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.44
Rot. Bonds3

About bis(1-methylimidazol-2-yl)-phenylmethanol

bis(1-methylimidazol-2-yl)-phenylmethanol (PubChem CID 2849523) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is bis(1-methylimidazol-2-yl)-phenylmethanol.

Molecular Properties

Compound Namebis(1-methylimidazol-2-yl)-phenylmethanol
PubChem CID2849523
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Namebis(1-methylimidazol-2-yl)-phenylmethanol
SMILESCn1ccnc1C(O)(c1ccccc1)c1nccn1C
InChIInChI=1S/C15H16N4O/c1-18-10-8-16-13(18)15(20,12-6-4-3-5-7-12)14-17-9-11-19(14)2/h3-11,20H,1-2H3
InChIKeyNWIYARUDRHTEHU-UHFFFAOYSA-N
XLogP1.44
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

alpha-(4-(2-Phenylethyl)phenyl)-1H-imidazole-1-ethanol
CID 53626
(1-Methylimidazol-2-yl)-diphenylmethanol
CID 3113722
2-(1H-imidazol-1-yl)-1-phenylethanol
CID 32239
Denzimol hydrochloride
CID 53625
(1-methyl-1H-imidazol-2-yl)(phenyl)methanol
CID 2859379
(1-ethyl-1H-imidazol-2-yl)(naphthalen-1-yl)methanol
CID 3131356
(5-chloro-1-methyl-1H-imidazol-2-yl)(diphenyl)methanol
CID 3795291
1-(4-methylphenyl)-1-phenyl-2-[1-(1-propenyl)-1H-imidazol-2-yl]ethanol
CID 6270550
(5-chloro-1-methyl-1H-imidazol-2-yl)(phenyl)methanol
CID 650470
(1-benzyl-1H-imidazol-2-yl)(phenyl)methanol
CID 2870369
3-(2-Methyl-1-imidazolyl)-1,1-diphenylpropanol
CID 15895912
(1-ethyl-1H-imidazol-2-yl)(diphenyl)methanol
CID 2881653

Frequently Asked Questions

What is the IUPAC name of bis(1-methylimidazol-2-yl)-phenylmethanol?
The IUPAC name of bis(1-methylimidazol-2-yl)-phenylmethanol (CID 2849523) is bis(1-methylimidazol-2-yl)-phenylmethanol.
What is the SMILES notation for bis(1-methylimidazol-2-yl)-phenylmethanol?
The canonical SMILES for bis(1-methylimidazol-2-yl)-phenylmethanol is Cn1ccnc1C(O)(c1ccccc1)c1nccn1C.
What is the InChIKey of bis(1-methylimidazol-2-yl)-phenylmethanol?
The InChIKey is NWIYARUDRHTEHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-18-10-8-16-13(18)15(20,12-6-4-3-5-7-12)14-17-9-11-19(14)2/h3-11,20H,1-2H3.
What are the key properties of bis(1-methylimidazol-2-yl)-phenylmethanol?
bis(1-methylimidazol-2-yl)-phenylmethanol has a molecular weight of 268.32 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-methylimidazol-2-yl)-phenylmethanol is sourced from PubChem (CID 2849523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).