2-methyl-N-(1-methyltetrazol-5-yl)benzamide

C10H11N5O — CID 925647

IUPAC2-methyl-N-(1-methyltetrazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1nnnn1C
InChIInChI=1S/C10H11N5O/c1-7-5-3-4-6-8(7)9(16)11-10-12-13-14-15(10)2/h3-6H,1-2H3,(H,11,12,14,16)
InChIKeyCFNQQIBGJKNSQN-UHFFFAOYSA-N
MW217.23 g/mol
LogP0.77
Rot. Bonds2

About 2-methyl-N-(1-methyltetrazol-5-yl)benzamide

2-methyl-N-(1-methyltetrazol-5-yl)benzamide (PubChem CID 925647) has the molecular formula C10H11N5O and a molecular weight of 217.23 g/mol. Its IUPAC name is 2-methyl-N-(1-methyltetrazol-5-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(1-methyltetrazol-5-yl)benzamide
PubChem CID925647
Molecular FormulaC10H11N5O
Molecular Weight217.23 g/mol
Exact Mass217.10
IUPAC Name2-methyl-N-(1-methyltetrazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1nnnn1C
InChIInChI=1S/C10H11N5O/c1-7-5-3-4-6-8(7)9(16)11-10-12-13-14-15(10)2/h3-6H,1-2H3,(H,11,12,14,16)
InChIKeyCFNQQIBGJKNSQN-UHFFFAOYSA-N
XLogP0.77
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methyltetrazol-5-yl)benzamide?
The IUPAC name of 2-methyl-N-(1-methyltetrazol-5-yl)benzamide (CID 925647) is 2-methyl-N-(1-methyltetrazol-5-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(1-methyltetrazol-5-yl)benzamide?
The canonical SMILES for 2-methyl-N-(1-methyltetrazol-5-yl)benzamide is Cc1ccccc1C(=O)Nc1nnnn1C.
What is the InChIKey of 2-methyl-N-(1-methyltetrazol-5-yl)benzamide?
The InChIKey is CFNQQIBGJKNSQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O/c1-7-5-3-4-6-8(7)9(16)11-10-12-13-14-15(10)2/h3-6H,1-2H3,(H,11,12,14,16).
What are the key properties of 2-methyl-N-(1-methyltetrazol-5-yl)benzamide?
2-methyl-N-(1-methyltetrazol-5-yl)benzamide has a molecular weight of 217.23 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methyltetrazol-5-yl)benzamide is sourced from PubChem (CID 925647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).