2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole

C11H10N4 — CID 135804529

IUPAC2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole
SMILESCc1cc(-c2nc3ccccc3[nH]2)n[nH]1
InChIInChI=1S/C11H10N4/c1-7-6-10(15-14-7)11-12-8-4-2-3-5-9(8)13-11/h2-6H,1H3,(H,12,13)(H,14,15)
InChIKeyQKIPYMLXPVRMJD-UHFFFAOYSA-N
MW198.23 g/mol
LogP2.26
Rot. Bonds1

About 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole

2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole (PubChem CID 135804529) has the molecular formula C11H10N4 and a molecular weight of 198.23 g/mol. Its IUPAC name is 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole.

Molecular Properties

Compound Name2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole
PubChem CID135804529
Molecular FormulaC11H10N4
Molecular Weight198.23 g/mol
Exact Mass198.09
IUPAC Name2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole
SMILESCc1cc(-c2nc3ccccc3[nH]2)n[nH]1
InChIInChI=1S/C11H10N4/c1-7-6-10(15-14-7)11-12-8-4-2-3-5-9(8)13-11/h2-6H,1H3,(H,12,13)(H,14,15)
InChIKeyQKIPYMLXPVRMJD-UHFFFAOYSA-N
XLogP2.26
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-3-(1H-benzimidazol-2-yl)-1H-pyridazin-6-one
CID 670851
2-(1-methylimidazol-4-yl)-1H-benzimidazole
CID 45078360
zinc;2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]-1H-benzimidazole;dichloride
CID 16721057
2-(1H-benzimidazol-2-yl)quinoline
CID 646533
3-(1H-benzimidazol-2-yl)-5-(4-methylphenyl)-1,2-oxazole
CID 135538073
platinum;2-pyridin-2-yl-1H-benzimidazole
CID 174864241
2-(5-methylthiophen-2-yl)-1H-benzimidazole
CID 870214
4-(1H-benzimidazol-2-yl)-2,6-dimethylaniline
CID 121004860
2-(2,4-dimethylphenyl)-1H-benzimidazole
CID 17010591
2-[6-(1H-benzimidazol-2-yl)-4-[4-[3,5-bis(1H-benzimidazol-2-yl)phenyl]phenyl]-2-pyridinyl]-1H-benzimidazole
CID 59359581
2-(4,6-diphenyl-2-pyridinyl)-1H-benzimidazole
CID 4268760
2-[4-[4-(1H-benzimidazol-2-yl)phenyl]phenyl]-1H-benzimidazole
CID 12522580

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole?
The IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole (CID 135804529) is 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole.
What is the SMILES notation for 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole?
The canonical SMILES for 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole is Cc1cc(-c2nc3ccccc3[nH]2)n[nH]1.
What is the InChIKey of 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole?
The InChIKey is QKIPYMLXPVRMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c1-7-6-10(15-14-7)11-12-8-4-2-3-5-9(8)13-11/h2-6H,1H3,(H,12,13)(H,14,15).
What are the key properties of 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole?
2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole has a molecular weight of 198.23 g/mol, XLogP of 2.26, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole is sourced from PubChem (CID 135804529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).