2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide

C16H15N5O3 — CID 7711579

IUPAC2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1cccc(-n2cnnn2)c1
InChIInChI=1S/C16H15N5O3/c1-23-13-7-4-8-14(24-2)15(13)16(22)18-11-5-3-6-12(9-11)21-10-17-19-20-21/h3-10H,1-2H3,(H,18,22)
InChIKeyVRVIHJUEWZIYSH-UHFFFAOYSA-N
MW325.33 g/mol
LogP1.93
Rot. Bonds5

About 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide

2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide (PubChem CID 7711579) has the molecular formula C16H15N5O3 and a molecular weight of 325.33 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide
PubChem CID7711579
Molecular FormulaC16H15N5O3
Molecular Weight325.33 g/mol
Exact Mass325.12
IUPAC Name2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1cccc(-n2cnnn2)c1
InChIInChI=1S/C16H15N5O3/c1-23-13-7-4-8-14(24-2)15(13)16(22)18-11-5-3-6-12(9-11)21-10-17-19-20-21/h3-10H,1-2H3,(H,18,22)
InChIKeyVRVIHJUEWZIYSH-UHFFFAOYSA-N
XLogP1.93
TPSA91.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2,6-dimethoxy-N-[3-(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

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide (CID 7711579) is 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide is COc1cccc(OC)c1C(=O)Nc1cccc(-n2cnnn2)c1.
What is the InChIKey of 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide?
The InChIKey is VRVIHJUEWZIYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O3/c1-23-13-7-4-8-14(24-2)15(13)16(22)18-11-5-3-6-12(9-11)21-10-17-19-20-21/h3-10H,1-2H3,(H,18,22).
What are the key properties of 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide?
2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide has a molecular weight of 325.33 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[3-(tetrazol-1-yl)phenyl]benzamide is sourced from PubChem (CID 7711579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).