N-phenyl-4-(tetrazol-1-yl)benzamide

C14H11N5O — CID 779646

IUPACN-phenyl-4-(tetrazol-1-yl)benzamide
SMILESO=C(Nc1ccccc1)c1ccc(-n2cnnn2)cc1
InChIInChI=1S/C14H11N5O/c20-14(16-12-4-2-1-3-5-12)11-6-8-13(9-7-11)19-10-15-17-18-19/h1-10H,(H,16,20)
InChIKeyDABFEBHKBHRZOH-UHFFFAOYSA-N
MW265.28 g/mol
LogP1.91
Rot. Bonds3

About N-phenyl-4-(tetrazol-1-yl)benzamide

N-phenyl-4-(tetrazol-1-yl)benzamide (PubChem CID 779646) has the molecular formula C14H11N5O and a molecular weight of 265.28 g/mol. Its IUPAC name is N-phenyl-4-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-phenyl-4-(tetrazol-1-yl)benzamide
PubChem CID779646
Molecular FormulaC14H11N5O
Molecular Weight265.28 g/mol
Exact Mass265.10
IUPAC NameN-phenyl-4-(tetrazol-1-yl)benzamide
SMILESO=C(Nc1ccccc1)c1ccc(-n2cnnn2)cc1
InChIInChI=1S/C14H11N5O/c20-14(16-12-4-2-1-3-5-12)11-6-8-13(9-7-11)19-10-15-17-18-19/h1-10H,(H,16,20)
InChIKeyDABFEBHKBHRZOH-UHFFFAOYSA-N
XLogP1.91
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-phenyl-4-(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

Frequently Asked Questions

What is the IUPAC name of N-phenyl-4-(tetrazol-1-yl)benzamide?
The IUPAC name of N-phenyl-4-(tetrazol-1-yl)benzamide (CID 779646) is N-phenyl-4-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-phenyl-4-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-phenyl-4-(tetrazol-1-yl)benzamide is O=C(Nc1ccccc1)c1ccc(-n2cnnn2)cc1.
What is the InChIKey of N-phenyl-4-(tetrazol-1-yl)benzamide?
The InChIKey is DABFEBHKBHRZOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O/c20-14(16-12-4-2-1-3-5-12)11-6-8-13(9-7-11)19-10-15-17-18-19/h1-10H,(H,16,20).
What are the key properties of N-phenyl-4-(tetrazol-1-yl)benzamide?
N-phenyl-4-(tetrazol-1-yl)benzamide has a molecular weight of 265.28 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-4-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 779646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).