N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide

C15H13N5O — CID 862130

IUPACN-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide
SMILESCc1ccccc1NC(=O)c1cccc(-n2cnnn2)c1
InChIInChI=1S/C15H13N5O/c1-11-5-2-3-8-14(11)17-15(21)12-6-4-7-13(9-12)20-10-16-18-19-20/h2-10H,1H3,(H,17,21)
InChIKeyBAZPXSMMEGQGDX-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.22
Rot. Bonds3

About N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide

N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide (PubChem CID 862130) has the molecular formula C15H13N5O and a molecular weight of 279.30 g/mol. Its IUPAC name is N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide
PubChem CID862130
Molecular FormulaC15H13N5O
Molecular Weight279.30 g/mol
Exact Mass279.11
IUPAC NameN-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide
SMILESCc1ccccc1NC(=O)c1cccc(-n2cnnn2)c1
InChIInChI=1S/C15H13N5O/c1-11-5-2-3-8-14(11)17-15(21)12-6-4-7-13(9-12)20-10-16-18-19-20/h2-10H,1H3,(H,17,21)
InChIKeyBAZPXSMMEGQGDX-UHFFFAOYSA-N
XLogP2.22
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-methyl-5-(tetrazol-1-yl)phenyl]benzamide
CID 60789520
N-(4,5-dimethoxy-2-methylphenyl)-3-(tetrazol-1-yl)benzamide
CID 26209349
N-(4-benzamido-2,5-dimethoxyphenyl)-3-(tetrazol-1-yl)benzamide
CID 26210844
N-(4-chloro-2-methoxy-5-methylphenyl)-3-(tetrazol-1-yl)benzamide
CID 18081318
N-(4-bromo-3-methylphenyl)-3-(tetrazol-1-yl)benzamide
CID 26363553
N-(1H-indol-4-yl)-3-(tetrazol-1-yl)benzamide
CID 71705732
N-(3-acetylphenyl)-3-(tetrazol-1-yl)benzamide
CID 862153
N-(2,5-dichlorophenyl)-3-(tetrazol-1-yl)benzamide
CID 16648846
N-[2-(2-ethylanilino)-2-oxoethyl]-3-(tetrazol-1-yl)benzamide
CID 31303419
N-[2-chloro-5-(tetrazol-1-yl)phenyl]-3-methylbenzamide
CID 50776835
N-(5-chloro-2-methoxyphenyl)-3-(tetrazol-1-yl)benzamide
CID 862139
methyl 4-[[3-(tetrazol-1-yl)benzoyl]amino]benzoate
CID 862155

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide?
The IUPAC name of N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide (CID 862130) is N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide is Cc1ccccc1NC(=O)c1cccc(-n2cnnn2)c1.
What is the InChIKey of N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide?
The InChIKey is BAZPXSMMEGQGDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O/c1-11-5-2-3-8-14(11)17-15(21)12-6-4-7-13(9-12)20-10-16-18-19-20/h2-10H,1H3,(H,17,21).
What are the key properties of N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide?
N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide has a molecular weight of 279.30 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-3-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 862130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).