N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide

C16H14N6O2 — CID 8701507

IUPACN-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccccc2-n2cnnn2)cc1
InChIInChI=1S/C16H14N6O2/c1-11(23)18-12-6-8-13(9-7-12)19-16(24)14-4-2-3-5-15(14)22-10-17-20-21-22/h2-10H,1H3,(H,18,23)(H,19,24)
InChIKeyBSOJYYVSBUPPGB-UHFFFAOYSA-N
MW322.33 g/mol
LogP1.87
Rot. Bonds4

About N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide

N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide (PubChem CID 8701507) has the molecular formula C16H14N6O2 and a molecular weight of 322.33 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide
PubChem CID8701507
Molecular FormulaC16H14N6O2
Molecular Weight322.33 g/mol
Exact Mass322.12
IUPAC NameN-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccccc2-n2cnnn2)cc1
InChIInChI=1S/C16H14N6O2/c1-11(23)18-12-6-8-13(9-7-12)19-16(24)14-4-2-3-5-15(14)22-10-17-20-21-22/h2-10H,1H3,(H,18,23)(H,19,24)
InChIKeyBSOJYYVSBUPPGB-UHFFFAOYSA-N
XLogP1.87
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.33
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(4-acetamidophenyl)-2-(tetrazol-1-yl)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

N-cyclohexyl-4-(tetrazol-1-yl)benzamide
CID 920441
N-phenyl-4-(tetrazol-1-yl)benzamide
CID 779646
N-(4-acetylphenyl)-4-(1H-tetrazol-1-yl)benzamide
CID 864758
N'-benzoyl-3-(1H-tetraazol-1-yl)benzohydrazide
CID 866071
3-chloro-N-[3-(1H-tetrazol-1-yl)phenyl]benzamide
CID 7693798
4-tert-butyl-N-[3-(1H-tetrazol-1-yl)phenyl]benzamide
CID 7708843
N-(4-fluorophenyl)-4-(1H-tetrazol-1-ylmethyl)benzamide
CID 712035
2-(3-Ethyl-4-oxo-3,4-dihydro-phthalazin-1-yl)-N-(3-methyl-4-tetrazol-1-yl-phenyl)-acetamide
CID 646115
N-[4-methyl-3-(1H-tetraazol-1-yl)phenyl]benzamide
CID 855937
4-tert-butyl-N-[4-methyl-3-(tetrazol-1-yl)phenyl]benzamide
CID 855944
(2-chlorophenyl)-N-(4-methyl-3-(1,2,3,4-tetraazolyl)phenyl)carboxamide
CID 855980
3-butyl-4-oxo-N-[4-(tetrazol-1-yl)phenyl]phthalazine-1-carboxamide
CID 9502257

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide (CID 8701507) is N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide is CC(=O)Nc1ccc(NC(=O)c2ccccc2-n2cnnn2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide?
The InChIKey is BSOJYYVSBUPPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N6O2/c1-11(23)18-12-6-8-13(9-7-12)19-16(24)14-4-2-3-5-15(14)22-10-17-20-21-22/h2-10H,1H3,(H,18,23)(H,19,24).
What are the key properties of N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide?
N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide has a molecular weight of 322.33 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 8701507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).