N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide

C14H15N7O — CID 74236191

IUPACN-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide
SMILESCN(CCn1cccn1)C(=O)c1ccccc1-c1nn[nH]n1
InChIInChI=1S/C14H15N7O/c1-20(9-10-21-8-4-7-15-21)14(22)12-6-3-2-5-11(12)13-16-18-19-17-13/h2-8H,9-10H2,1H3,(H,16,17,18,19)
InChIKeySXJSALVDEHNGMZ-UHFFFAOYSA-N
MW297.32 g/mol
LogP0.84
Rot. Bonds5

About N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide

N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide (PubChem CID 74236191) has the molecular formula C14H15N7O and a molecular weight of 297.32 g/mol. Its IUPAC name is N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound NameN-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide
PubChem CID74236191
Molecular FormulaC14H15N7O
Molecular Weight297.32 g/mol
Exact Mass297.13
IUPAC NameN-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide
SMILESCN(CCn1cccn1)C(=O)c1ccccc1-c1nn[nH]n1
InChIInChI=1S/C14H15N7O/c1-20(9-10-21-8-4-7-15-21)14(22)12-6-3-2-5-11(12)13-16-18-19-17-13/h2-8H,9-10H2,1H3,(H,16,17,18,19)
InChIKeySXJSALVDEHNGMZ-UHFFFAOYSA-N
XLogP0.84
TPSA92.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-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-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide (CID 74236191) is N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide is CN(CCn1cccn1)C(=O)c1ccccc1-c1nn[nH]n1.
What is the InChIKey of N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide?
The InChIKey is SXJSALVDEHNGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N7O/c1-20(9-10-21-8-4-7-15-21)14(22)12-6-3-2-5-11(12)13-16-18-19-17-13/h2-8H,9-10H2,1H3,(H,16,17,18,19).
What are the key properties of N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide?
N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide has a molecular weight of 297.32 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 74236191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).