(3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol

C22H20N2O — CID 155552905

IUPAC(3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol
SMILESCc1cc(C)cc(C(O)c2ncc(-c3cccc4ccccc34)[nH]2)c1
InChIInChI=1S/C22H20N2O/c1-14-10-15(2)12-17(11-14)21(25)22-23-13-20(24-22)19-9-5-7-16-6-3-4-8-18(16)19/h3-13,21,25H,1-2H3,(H,23,24)
InChIKeyKXQBLMCMOZBNIA-UHFFFAOYSA-N
MW328.42 g/mol
LogP4.93
Rot. Bonds3

About (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol

(3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol (PubChem CID 155552905) has the molecular formula C22H20N2O and a molecular weight of 328.42 g/mol. Its IUPAC name is (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol.

Molecular Properties

Compound Name(3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol
PubChem CID155552905
Molecular FormulaC22H20N2O
Molecular Weight328.42 g/mol
Exact Mass328.16
IUPAC Name(3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol
SMILESCc1cc(C)cc(C(O)c2ncc(-c3cccc4ccccc34)[nH]2)c1
InChIInChI=1S/C22H20N2O/c1-14-10-15(2)12-17(11-14)21(25)22-23-13-20(24-22)19-9-5-7-16-6-3-4-8-18(16)19/h3-13,21,25H,1-2H3,(H,23,24)
InChIKeyKXQBLMCMOZBNIA-UHFFFAOYSA-N
XLogP4.93
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol?
The IUPAC name of (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol (CID 155552905) is (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol.
What is the SMILES notation for (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol?
The canonical SMILES for (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol is Cc1cc(C)cc(C(O)c2ncc(-c3cccc4ccccc34)[nH]2)c1.
What is the InChIKey of (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol?
The InChIKey is KXQBLMCMOZBNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O/c1-14-10-15(2)12-17(11-14)21(25)22-23-13-20(24-22)19-9-5-7-16-6-3-4-8-18(16)19/h3-13,21,25H,1-2H3,(H,23,24).
What are the key properties of (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol?
(3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol has a molecular weight of 328.42 g/mol, XLogP of 4.93, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylphenyl)-(5-naphthalen-1-yl-1H-imidazol-2-yl)methanol is sourced from PubChem (CID 155552905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).