6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole

C11H10N4O — CID 135567140

IUPAC6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole
SMILESCOc1ccc2nc(-c3ccn[nH]3)[nH]c2c1
InChIInChI=1S/C11H10N4O/c1-16-7-2-3-8-10(6-7)14-11(13-8)9-4-5-12-15-9/h2-6H,1H3,(H,12,15)(H,13,14)
InChIKeyKSQSJEOPBMYGOB-UHFFFAOYSA-N
MW214.23 g/mol
LogP1.96
Rot. Bonds2

About 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole

6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole (PubChem CID 135567140) has the molecular formula C11H10N4O and a molecular weight of 214.23 g/mol. Its IUPAC name is 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole.

Molecular Properties

Compound Name6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole
PubChem CID135567140
Molecular FormulaC11H10N4O
Molecular Weight214.23 g/mol
Exact Mass214.09
IUPAC Name6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole
SMILESCOc1ccc2nc(-c3ccn[nH]3)[nH]c2c1
InChIInChI=1S/C11H10N4O/c1-16-7-2-3-8-10(6-7)14-11(13-8)9-4-5-12-15-9/h2-6H,1H3,(H,12,15)(H,13,14)
InChIKeyKSQSJEOPBMYGOB-UHFFFAOYSA-N
XLogP1.96
TPSA66.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-2-methyl-1H-1,3-benzodiazole
CID 3509826
3-[5-(5-Ethoxy-6-Fluoro-1h-Benzimidazol-2-Yl)-1h-Pyrazol-4-Yl]-1,1-Diethylurea
CID 135566617
N-((5-(3-(5-methoxy-1H-benzo[d]imidazol-2-yl)-1H-pyrazolo[3,4-b]pyridin-5-yl)pyridin-3-yl)methyl)ethanamine
CID 135497841
6-methoxy-2-pyridin-2-yl-1H-benzimidazole
CID 186762
1-(5-Methoxy-1H-benzoimidazol-2-yl)-1H-pyrazole-4-
CID 44482167
1-[5-[3-(6-methoxy-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-N-methylmethanamine
CID 135497835
N-[[5-[3-(6-methoxy-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]propan-1-amine
CID 135497843
N-[[5-[3-(6-methoxy-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]butan-1-amine
CID 135497844
4-(6-methoxy-1H-benzimidazol-2-yl)-1,2,5-oxadiazol-3-amine
CID 135522271
6-methoxy-2-(4-(2-(4-methylpyridin-3-yl)vinyl)-1H-pyrazol-3-yl)-1H-benzo[d]imidazole
CID 135620673
5-(2-(3-(6-methoxy-1H-benzo[d]imidazol-2-yl)-1H-pyrazol-4-yl)vinyl)nicotinonitrile
CID 135620674
methyl 5-(2-(3-(6-methoxy-1H-benzo[d]imidazol-2-yl)-1H-pyrazol-4-yl)vinyl)nicotinate
CID 135620676

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole?
The IUPAC name of 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole (CID 135567140) is 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole.
What is the SMILES notation for 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole?
The canonical SMILES for 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole is COc1ccc2nc(-c3ccn[nH]3)[nH]c2c1.
What is the InChIKey of 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole?
The InChIKey is KSQSJEOPBMYGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O/c1-16-7-2-3-8-10(6-7)14-11(13-8)9-4-5-12-15-9/h2-6H,1H3,(H,12,15)(H,13,14).
What are the key properties of 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole?
6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole has a molecular weight of 214.23 g/mol, XLogP of 1.96, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-(1H-pyrazol-5-yl)-1H-benzimidazole is sourced from PubChem (CID 135567140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).