(3-methyl-2-propylimidazol-4-yl)-diphenylmethanol

C20H22N2O — CID 2852013

IUPAC(3-methyl-2-propylimidazol-4-yl)-diphenylmethanol
SMILESCCCc1ncc(C(O)(c2ccccc2)c2ccccc2)n1C
InChIInChI=1S/C20H22N2O/c1-3-10-19-21-15-18(22(19)2)20(23,16-11-6-4-7-12-16)17-13-8-5-9-14-17/h4-9,11-15,23H,3,10H2,1-2H3
InChIKeyHVFJCTZJWXDMNJ-UHFFFAOYSA-N
MW306.41 g/mol
LogP3.66
Rot. Bonds5

About (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol

(3-methyl-2-propylimidazol-4-yl)-diphenylmethanol (PubChem CID 2852013) has the molecular formula C20H22N2O and a molecular weight of 306.41 g/mol. Its IUPAC name is (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol.

Molecular Properties

Compound Name(3-methyl-2-propylimidazol-4-yl)-diphenylmethanol
PubChem CID2852013
Molecular FormulaC20H22N2O
Molecular Weight306.41 g/mol
Exact Mass306.17
IUPAC Name(3-methyl-2-propylimidazol-4-yl)-diphenylmethanol
SMILESCCCc1ncc(C(O)(c2ccccc2)c2ccccc2)n1C
InChIInChI=1S/C20H22N2O/c1-3-10-19-21-15-18(22(19)2)20(23,16-11-6-4-7-12-16)17-13-8-5-9-14-17/h4-9,11-15,23H,3,10H2,1-2H3
InChIKeyHVFJCTZJWXDMNJ-UHFFFAOYSA-N
XLogP3.66
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol?
The IUPAC name of (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol (CID 2852013) is (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol.
What is the SMILES notation for (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol?
The canonical SMILES for (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol is CCCc1ncc(C(O)(c2ccccc2)c2ccccc2)n1C.
What is the InChIKey of (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol?
The InChIKey is HVFJCTZJWXDMNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O/c1-3-10-19-21-15-18(22(19)2)20(23,16-11-6-4-7-12-16)17-13-8-5-9-14-17/h4-9,11-15,23H,3,10H2,1-2H3.
What are the key properties of (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol?
(3-methyl-2-propylimidazol-4-yl)-diphenylmethanol has a molecular weight of 306.41 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-2-propylimidazol-4-yl)-diphenylmethanol is sourced from PubChem (CID 2852013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).