2-methyl-N-(2H-tetrazol-5-yl)benzamide

C9H9N5O — CID 897135

IUPAC2-methyl-N-(2H-tetrazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C9H9N5O/c1-6-4-2-3-5-7(6)8(15)10-9-11-13-14-12-9/h2-5H,1H3,(H2,10,11,12,13,14,15)
InChIKeyCPDSKRADSLRTFN-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.76
Rot. Bonds2

About 2-methyl-N-(2H-tetrazol-5-yl)benzamide

2-methyl-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 897135) has the molecular formula C9H9N5O and a molecular weight of 203.20 g/mol. Its IUPAC name is 2-methyl-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(2H-tetrazol-5-yl)benzamide
PubChem CID897135
Molecular FormulaC9H9N5O
Molecular Weight203.20 g/mol
Exact Mass203.08
IUPAC Name2-methyl-N-(2H-tetrazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C9H9N5O/c1-6-4-2-3-5-7(6)8(15)10-9-11-13-14-12-9/h2-5H,1H3,(H2,10,11,12,13,14,15)
InChIKeyCPDSKRADSLRTFN-UHFFFAOYSA-N
XLogP0.76
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 2-methyl-N-(2H-tetrazol-5-yl)benzamide (CID 897135) is 2-methyl-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 2-methyl-N-(2H-tetrazol-5-yl)benzamide is Cc1ccccc1C(=O)Nc1nn[nH]n1.
What is the InChIKey of 2-methyl-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is CPDSKRADSLRTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5O/c1-6-4-2-3-5-7(6)8(15)10-9-11-13-14-12-9/h2-5H,1H3,(H2,10,11,12,13,14,15).
What are the key properties of 2-methyl-N-(2H-tetrazol-5-yl)benzamide?
2-methyl-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 203.20 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 897135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).