2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol

C16H16N2O — CID 3070221

IUPAC2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol
SMILESCN1C(c2ccccc2O)=NCC1c1ccccc1
InChIInChI=1S/C16H16N2O/c1-18-14(12-7-3-2-4-8-12)11-17-16(18)13-9-5-6-10-15(13)19/h2-10,14,19H,11H2,1H3
InChIKeyWKQGORHVDYTJFB-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.83
Rot. Bonds2

About 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol

2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol (PubChem CID 3070221) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol.

Molecular Properties

Compound Name2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol
PubChem CID3070221
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol
SMILESCN1C(c2ccccc2O)=NCC1c1ccccc1
InChIInChI=1S/C16H16N2O/c1-18-14(12-7-3-2-4-8-12)11-17-16(18)13-9-5-6-10-15(13)19/h2-10,14,19H,11H2,1H3
InChIKeyWKQGORHVDYTJFB-UHFFFAOYSA-N
XLogP2.83
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol?
The IUPAC name of 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol (CID 3070221) is 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol.
What is the SMILES notation for 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol?
The canonical SMILES for 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol is CN1C(c2ccccc2O)=NCC1c1ccccc1.
What is the InChIKey of 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol?
The InChIKey is WKQGORHVDYTJFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-18-14(12-7-3-2-4-8-12)11-17-16(18)13-9-5-6-10-15(13)19/h2-10,14,19H,11H2,1H3.
What are the key properties of 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol?
2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol has a molecular weight of 252.32 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol is sourced from PubChem (CID 3070221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).