1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol

C19H20N2O — CID 12043372

IUPAC1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol
SMILESCC(C)C(O)(c1ccc(-c2ccccc2)cc1)c1cnc[nH]1
InChIInChI=1S/C19H20N2O/c1-14(2)19(22,18-12-20-13-21-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14,22H,1-2H3,(H,20,21)
InChIKeyZXKRGWHSNSRDIS-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.97
Rot. Bonds4

About 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol

1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol (PubChem CID 12043372) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol.

Molecular Properties

Compound Name1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol
PubChem CID12043372
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol
SMILESCC(C)C(O)(c1ccc(-c2ccccc2)cc1)c1cnc[nH]1
InChIInChI=1S/C19H20N2O/c1-14(2)19(22,18-12-20-13-21-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14,22H,1-2H3,(H,20,21)
InChIKeyZXKRGWHSNSRDIS-UHFFFAOYSA-N
XLogP3.97
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol?
The IUPAC name of 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol (CID 12043372) is 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol.
What is the SMILES notation for 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol?
The canonical SMILES for 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol is CC(C)C(O)(c1ccc(-c2ccccc2)cc1)c1cnc[nH]1.
What is the InChIKey of 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol?
The InChIKey is ZXKRGWHSNSRDIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-14(2)19(22,18-12-20-13-21-18)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14,22H,1-2H3,(H,20,21).
What are the key properties of 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol?
1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol has a molecular weight of 292.38 g/mol, XLogP of 3.97, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-imidazol-5-yl)-2-methyl-1-(4-phenylphenyl)propan-1-ol is sourced from PubChem (CID 12043372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).