6-(2-methyltetrazol-5-yl)-1H-benzimidazole

C9H8N6 — CID 91211393

IUPAC6-(2-methyltetrazol-5-yl)-1H-benzimidazole
SMILESCn1nnc(-c2ccc3nc[nH]c3c2)n1
InChIInChI=1S/C9H8N6/c1-15-13-9(12-14-15)6-2-3-7-8(4-6)11-5-10-7/h2-5H,1H3,(H,10,11)
InChIKeyOGSHPENCWSAOLD-UHFFFAOYSA-N
MW200.21 g/mol
LogP0.75
Rot. Bonds1

About 6-(2-methyltetrazol-5-yl)-1H-benzimidazole

6-(2-methyltetrazol-5-yl)-1H-benzimidazole (PubChem CID 91211393) has the molecular formula C9H8N6 and a molecular weight of 200.21 g/mol. Its IUPAC name is 6-(2-methyltetrazol-5-yl)-1H-benzimidazole.

Molecular Properties

Compound Name6-(2-methyltetrazol-5-yl)-1H-benzimidazole
PubChem CID91211393
Molecular FormulaC9H8N6
Molecular Weight200.21 g/mol
Exact Mass200.08
IUPAC Name6-(2-methyltetrazol-5-yl)-1H-benzimidazole
SMILESCn1nnc(-c2ccc3nc[nH]c3c2)n1
InChIInChI=1S/C9H8N6/c1-15-13-9(12-14-15)6-2-3-7-8(4-6)11-5-10-7/h2-5H,1H3,(H,10,11)
InChIKeyOGSHPENCWSAOLD-UHFFFAOYSA-N
XLogP0.75
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.21
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(1-ethyltriazol-4-yl)-1H-benzimidazole
CID 118693287
1-(3H-benzimidazol-5-yl)-1-[4-(2-propyltetrazol-5-yl)phenyl]ethane-1,2-diamine
CID 146422697
2-methoxy-5-(2-methyltetrazol-5-yl)benzaldehyde
CID 10488996
6-(4-methylsulfonylphenyl)-1H-benzimidazole
CID 39830614
5-(3H-benzimidazol-5-yl)-3-(1-tert-butylbenzotriazol-5-yl)-1,2,4-oxadiazole
CID 175923429
4-(2-methyltetrazol-5-yl)benzenesulfonyl chloride
CID 84806034
3-(2-methyltetrazol-5-yl)benzenethiol
CID 142338524
3-(3H-benzimidazol-5-yl)-4-(1-hydroxyethyl)benzamide
CID 171064601
2-(3H-benzimidazol-5-yl)-5-methylsulfanyl-1,3-oxazole
CID 143620068
3-(3H-benzimidazol-5-yl)-N,N-dimethylbenzamide
CID 175533007
7-(2-methyltetrazol-5-yl)isoquinoline
CID 171560087
6-[4-(5-methylthiophen-3-yl)phenyl]-1H-benzimidazole
CID 175227051

Frequently Asked Questions

What is the IUPAC name of 6-(2-methyltetrazol-5-yl)-1H-benzimidazole?
The IUPAC name of 6-(2-methyltetrazol-5-yl)-1H-benzimidazole (CID 91211393) is 6-(2-methyltetrazol-5-yl)-1H-benzimidazole.
What is the SMILES notation for 6-(2-methyltetrazol-5-yl)-1H-benzimidazole?
The canonical SMILES for 6-(2-methyltetrazol-5-yl)-1H-benzimidazole is Cn1nnc(-c2ccc3nc[nH]c3c2)n1.
What is the InChIKey of 6-(2-methyltetrazol-5-yl)-1H-benzimidazole?
The InChIKey is OGSHPENCWSAOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N6/c1-15-13-9(12-14-15)6-2-3-7-8(4-6)11-5-10-7/h2-5H,1H3,(H,10,11).
What are the key properties of 6-(2-methyltetrazol-5-yl)-1H-benzimidazole?
6-(2-methyltetrazol-5-yl)-1H-benzimidazole has a molecular weight of 200.21 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methyltetrazol-5-yl)-1H-benzimidazole is sourced from PubChem (CID 91211393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).