6-methoxy-2-naphthalen-1-yl-1H-benzimidazole

C18H14N2O — CID 65017512

IUPAC6-methoxy-2-naphthalen-1-yl-1H-benzimidazole
SMILESCOc1ccc2nc(-c3cccc4ccccc34)[nH]c2c1
InChIInChI=1S/C18H14N2O/c1-21-13-9-10-16-17(11-13)20-18(19-16)15-8-4-6-12-5-2-3-7-14(12)15/h2-11H,1H3,(H,19,20)
InChIKeySZGCFFGWPHVBRR-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.39
Rot. Bonds2

About 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole

6-methoxy-2-naphthalen-1-yl-1H-benzimidazole (PubChem CID 65017512) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole.

Molecular Properties

Compound Name6-methoxy-2-naphthalen-1-yl-1H-benzimidazole
PubChem CID65017512
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name6-methoxy-2-naphthalen-1-yl-1H-benzimidazole
SMILESCOc1ccc2nc(-c3cccc4ccccc34)[nH]c2c1
InChIInChI=1S/C18H14N2O/c1-21-13-9-10-16-17(11-13)20-18(19-16)15-8-4-6-12-5-2-3-7-14(12)15/h2-11H,1H3,(H,19,20)
InChIKeySZGCFFGWPHVBRR-UHFFFAOYSA-N
XLogP4.39
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-naphthalen-1-yl-6-(trifluoromethoxy)-1H-benzimidazole
CID 155599071
2-(2-fluorophenyl)-6-methoxy-1H-benzimidazole
CID 65017607
2-[2-(6-methoxy-1H-benzimidazol-2-yl)phenyl]ethanamine
CID 65017722
2-naphthalen-1-yl-3H-benzimidazol-5-ol
CID 81432399
2-chloro-6-(6-methoxy-1H-benzimidazol-2-yl)aniline
CID 107049937
N-[2-(6-methoxy-1H-benzimidazol-2-yl)phenyl]acetamide
CID 18984570
2-(2,5-dimethylphenyl)-6-methoxy-1H-benzimidazole
CID 65017877
2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole
CID 65017699
3-(6-methoxy-1H-benzimidazol-2-yl)aniline
CID 754001
6-methoxy-2-[2-(3,4,5-trimethoxyphenyl)-3-pyridinyl]-1H-benzimidazole
CID 155550554
N-[(6-methoxy-1H-benzimidazol-2-yl)methyl]-1-naphthalen-1-ylmethanamine
CID 134084471
methyl 2-anthracen-1-yl-3H-benzimidazole-5-carboxylate
CID 175322054

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole?
The IUPAC name of 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole (CID 65017512) is 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole.
What is the SMILES notation for 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole?
The canonical SMILES for 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole is COc1ccc2nc(-c3cccc4ccccc34)[nH]c2c1.
What is the InChIKey of 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole?
The InChIKey is SZGCFFGWPHVBRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c1-21-13-9-10-16-17(11-13)20-18(19-16)15-8-4-6-12-5-2-3-7-14(12)15/h2-11H,1H3,(H,19,20).
What are the key properties of 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole?
6-methoxy-2-naphthalen-1-yl-1H-benzimidazole has a molecular weight of 274.32 g/mol, XLogP of 4.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-naphthalen-1-yl-1H-benzimidazole is sourced from PubChem (CID 65017512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).