4-(5-phenoxytetrazol-1-yl)benzamide

C14H11N5O2 — CID 1253744

IUPAC4-(5-phenoxytetrazol-1-yl)benzamide
SMILESNC(=O)c1ccc(-n2nnnc2Oc2ccccc2)cc1
InChIInChI=1S/C14H11N5O2/c15-13(20)10-6-8-11(9-7-10)19-14(16-17-18-19)21-12-4-2-1-3-5-12/h1-9H,(H2,15,20)
InChIKeyWDAVAVJXCWAEAN-UHFFFAOYSA-N
MW281.28 g/mol
LogP1.55
Rot. Bonds4

About 4-(5-phenoxytetrazol-1-yl)benzamide

4-(5-phenoxytetrazol-1-yl)benzamide (PubChem CID 1253744) has the molecular formula C14H11N5O2 and a molecular weight of 281.28 g/mol. Its IUPAC name is 4-(5-phenoxytetrazol-1-yl)benzamide.

Molecular Properties

Compound Name4-(5-phenoxytetrazol-1-yl)benzamide
PubChem CID1253744
Molecular FormulaC14H11N5O2
Molecular Weight281.28 g/mol
Exact Mass281.09
IUPAC Name4-(5-phenoxytetrazol-1-yl)benzamide
SMILESNC(=O)c1ccc(-n2nnnc2Oc2ccccc2)cc1
InChIInChI=1S/C14H11N5O2/c15-13(20)10-6-8-11(9-7-10)19-14(16-17-18-19)21-12-4-2-1-3-5-12/h1-9H,(H2,15,20)
InChIKeyWDAVAVJXCWAEAN-UHFFFAOYSA-N
XLogP1.55
TPSA95.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(5-phenoxytetrazol-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 4-(5-phenoxytetrazol-1-yl)benzamide?
The IUPAC name of 4-(5-phenoxytetrazol-1-yl)benzamide (CID 1253744) is 4-(5-phenoxytetrazol-1-yl)benzamide.
What is the SMILES notation for 4-(5-phenoxytetrazol-1-yl)benzamide?
The canonical SMILES for 4-(5-phenoxytetrazol-1-yl)benzamide is NC(=O)c1ccc(-n2nnnc2Oc2ccccc2)cc1.
What is the InChIKey of 4-(5-phenoxytetrazol-1-yl)benzamide?
The InChIKey is WDAVAVJXCWAEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O2/c15-13(20)10-6-8-11(9-7-10)19-14(16-17-18-19)21-12-4-2-1-3-5-12/h1-9H,(H2,15,20).
What are the key properties of 4-(5-phenoxytetrazol-1-yl)benzamide?
4-(5-phenoxytetrazol-1-yl)benzamide has a molecular weight of 281.28 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-phenoxytetrazol-1-yl)benzamide is sourced from PubChem (CID 1253744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).