N-(2-ethyltetrazol-5-yl)-2-phenylacetamide

C11H13N5O — CID 969016

IUPACN-(2-ethyltetrazol-5-yl)-2-phenylacetamide
SMILESCCn1nnc(NC(=O)Cc2ccccc2)n1
InChIInChI=1S/C11H13N5O/c1-2-16-14-11(13-15-16)12-10(17)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14,17)
InChIKeyRKUCDQRULQFUJG-UHFFFAOYSA-N
MW231.26 g/mol
LogP0.87
Rot. Bonds4

About N-(2-ethyltetrazol-5-yl)-2-phenylacetamide

N-(2-ethyltetrazol-5-yl)-2-phenylacetamide (PubChem CID 969016) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is N-(2-ethyltetrazol-5-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(2-ethyltetrazol-5-yl)-2-phenylacetamide
PubChem CID969016
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC NameN-(2-ethyltetrazol-5-yl)-2-phenylacetamide
SMILESCCn1nnc(NC(=O)Cc2ccccc2)n1
InChIInChI=1S/C11H13N5O/c1-2-16-14-11(13-15-16)12-10(17)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14,17)
InChIKeyRKUCDQRULQFUJG-UHFFFAOYSA-N
XLogP0.87
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-ethyltetrazol-5-yl)-2-phenylacetamide 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-(2-ethyltetrazol-5-yl)-2-phenylacetamide?
The IUPAC name of N-(2-ethyltetrazol-5-yl)-2-phenylacetamide (CID 969016) is N-(2-ethyltetrazol-5-yl)-2-phenylacetamide.
What is the SMILES notation for N-(2-ethyltetrazol-5-yl)-2-phenylacetamide?
The canonical SMILES for N-(2-ethyltetrazol-5-yl)-2-phenylacetamide is CCn1nnc(NC(=O)Cc2ccccc2)n1.
What is the InChIKey of N-(2-ethyltetrazol-5-yl)-2-phenylacetamide?
The InChIKey is RKUCDQRULQFUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c1-2-16-14-11(13-15-16)12-10(17)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14,17).
What are the key properties of N-(2-ethyltetrazol-5-yl)-2-phenylacetamide?
N-(2-ethyltetrazol-5-yl)-2-phenylacetamide has a molecular weight of 231.26 g/mol, XLogP of 0.87, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyltetrazol-5-yl)-2-phenylacetamide is sourced from PubChem (CID 969016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).