(3-methylimidazol-4-yl)-naphthalen-2-ylmethanol

C15H14N2O — CID 66116281

IUPAC(3-methylimidazol-4-yl)-naphthalen-2-ylmethanol
SMILESCn1cncc1C(O)c1ccc2ccccc2c1
InChIInChI=1S/C15H14N2O/c1-17-10-16-9-14(17)15(18)13-7-6-11-4-2-3-5-12(11)8-13/h2-10,15,18H,1H3
InChIKeyBPJFYJZLNXUZMO-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.65
Rot. Bonds2

About (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol

(3-methylimidazol-4-yl)-naphthalen-2-ylmethanol (PubChem CID 66116281) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol.

Molecular Properties

Compound Name(3-methylimidazol-4-yl)-naphthalen-2-ylmethanol
PubChem CID66116281
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name(3-methylimidazol-4-yl)-naphthalen-2-ylmethanol
SMILESCn1cncc1C(O)c1ccc2ccccc2c1
InChIInChI=1S/C15H14N2O/c1-17-10-16-9-14(17)15(18)13-7-6-11-4-2-3-5-12(11)8-13/h2-10,15,18H,1H3
InChIKeyBPJFYJZLNXUZMO-UHFFFAOYSA-N
XLogP2.65
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,4-dimethoxyphenyl)-(3-methylimidazol-4-yl)methanol
CID 66116292
(3-methylimidazol-4-yl)-[3-(trifluoromethoxy)phenyl]methanol
CID 66118408
(4-ethoxyphenyl)-(3-methylimidazol-4-yl)methanol
CID 66118611
4-[hydroxy-(3-methylimidazol-4-yl)methyl]-2-(3-phenylphenyl)benzonitrile
CID 70134318
(3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol
CID 66116496
(3-methylimidazol-4-yl)-(5-methylthiophen-3-yl)methanol
CID 66116920
4-[hydroxy-(3-methylimidazol-4-yl)methyl]-2-(4-methylphenyl)benzonitrile
CID 70135010
methyl (2R)-2-(3-methylimidazol-4-yl)-2-(naphthalene-2-carbonylamino)acetate
CID 100677397
1-(3-methylimidazol-4-yl)-2-phenylethanol
CID 66118824
anthracen-2-yl(phenyl)methanol
CID 15685338
[4-(3-chlorophenyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)methanol
CID 22048492
(2-methylsulfanylphenyl)-naphthalen-2-ylmethanol
CID 115792773

Frequently Asked Questions

What is the IUPAC name of (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol?
The IUPAC name of (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol (CID 66116281) is (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol.
What is the SMILES notation for (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol?
The canonical SMILES for (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol is Cn1cncc1C(O)c1ccc2ccccc2c1.
What is the InChIKey of (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol?
The InChIKey is BPJFYJZLNXUZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-17-10-16-9-14(17)15(18)13-7-6-11-4-2-3-5-12(11)8-13/h2-10,15,18H,1H3.
What are the key properties of (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol?
(3-methylimidazol-4-yl)-naphthalen-2-ylmethanol has a molecular weight of 238.29 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylimidazol-4-yl)-naphthalen-2-ylmethanol is sourced from PubChem (CID 66116281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).