2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide

C16H15N5O — CID 26729305

IUPAC2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(-n3cnnn3)cc2)c(C)c1
InChIInChI=1S/C16H15N5O/c1-11-3-8-15(12(2)9-11)16(22)18-13-4-6-14(7-5-13)21-10-17-19-20-21/h3-10H,1-2H3,(H,18,22)
InChIKeyPQQUFOWYBXLQJR-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.53
Rot. Bonds3

About 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide

2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide (PubChem CID 26729305) has the molecular formula C16H15N5O and a molecular weight of 293.33 g/mol. Its IUPAC name is 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide
PubChem CID26729305
Molecular FormulaC16H15N5O
Molecular Weight293.33 g/mol
Exact Mass293.13
IUPAC Name2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(-n3cnnn3)cc2)c(C)c1
InChIInChI=1S/C16H15N5O/c1-11-3-8-15(12(2)9-11)16(22)18-13-4-6-14(7-5-13)21-10-17-19-20-21/h3-10H,1-2H3,(H,18,22)
InChIKeyPQQUFOWYBXLQJR-UHFFFAOYSA-N
XLogP2.53
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,6-dimethyl-N-[4-(tetrazol-1-yl)phenyl]quinoline-4-carboxamide
CID 18079833
(E)-3-(2,4-dimethylphenyl)-N-[4-(tetrazol-1-yl)phenyl]prop-2-enamide
CID 167933207
4-iodo-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 26729235
N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide
CID 7465186
5-bromo-2-chloro-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 40622208
N-[4-(tetrazol-1-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 7930055
N-[4-(2,4-dimethylphenyl)sulfanylphenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 30876231
N-[4-(azepan-1-yl)phenyl]-2,4-dimethylbenzamide
CID 60593055
2,3-dichloro-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 26729277
2-chloro-4-nitro-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 7930073
2-methyl-N'-[4-(tetrazol-1-yl)benzoyl]benzohydrazide
CID 30878039
3,4,5-trimethoxy-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 17012125

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide?
The IUPAC name of 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide (CID 26729305) is 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide.
What is the SMILES notation for 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide?
The canonical SMILES for 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide is Cc1ccc(C(=O)Nc2ccc(-n3cnnn3)cc2)c(C)c1.
What is the InChIKey of 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide?
The InChIKey is PQQUFOWYBXLQJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O/c1-11-3-8-15(12(2)9-11)16(22)18-13-4-6-14(7-5-13)21-10-17-19-20-21/h3-10H,1-2H3,(H,18,22).
What are the key properties of 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide?
2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide has a molecular weight of 293.33 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-[4-(tetrazol-1-yl)phenyl]benzamide is sourced from PubChem (CID 26729305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).