2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide

C18H19N5O — CID 24564895

IUPAC2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide
SMILESCCCc1ccc(NC(=O)Cn2nnc(-c3ccccc3)n2)cc1
InChIInChI=1S/C18H19N5O/c1-2-6-14-9-11-16(12-10-14)19-17(24)13-23-21-18(20-22-23)15-7-4-3-5-8-15/h3-5,7-12H,2,6,13H2,1H3,(H,19,24)
InChIKeyPBFZQRXVAKYIJG-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.93
Rot. Bonds6

About 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide

2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide (PubChem CID 24564895) has the molecular formula C18H19N5O and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide.

Molecular Properties

Compound Name2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide
PubChem CID24564895
Molecular FormulaC18H19N5O
Molecular Weight321.38 g/mol
Exact Mass321.16
IUPAC Name2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide
SMILESCCCc1ccc(NC(=O)Cn2nnc(-c3ccccc3)n2)cc1
InChIInChI=1S/C18H19N5O/c1-2-6-14-9-11-16(12-10-14)19-17(24)13-23-21-18(20-22-23)15-7-4-3-5-8-15/h3-5,7-12H,2,6,13H2,1H3,(H,19,24)
InChIKeyPBFZQRXVAKYIJG-UHFFFAOYSA-N
XLogP2.93
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-tert-butylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 16508157
N-[4-(cyanomethyl)phenyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 3995748
N-(4-phenoxyphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634205
N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 16508158
N-[4-[2-(5-phenyltetrazol-2-yl)acetyl]phenyl]butanamide
CID 51173918
N-(3,4-dimethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 16561616
2-[5-(4-fluorophenyl)tetrazol-2-yl]-N-phenylacetamide
CID 860418
N-(3-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 856053
2-[5-[4-(dimethylamino)phenyl]tetrazol-2-yl]-N-phenylacetamide
CID 860998
N-(3-bromo-4-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634201
N-(4-ethylphenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]acetamide
CID 7490049
N-(4-chloro-3-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 17014887

Frequently Asked Questions

What is the IUPAC name of 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide?
The IUPAC name of 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide (CID 24564895) is 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide.
What is the SMILES notation for 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide?
The canonical SMILES for 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide is CCCc1ccc(NC(=O)Cn2nnc(-c3ccccc3)n2)cc1.
What is the InChIKey of 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide?
The InChIKey is PBFZQRXVAKYIJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O/c1-2-6-14-9-11-16(12-10-14)19-17(24)13-23-21-18(20-22-23)15-7-4-3-5-8-15/h3-5,7-12H,2,6,13H2,1H3,(H,19,24).
What are the key properties of 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide?
2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide has a molecular weight of 321.38 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide is sourced from PubChem (CID 24564895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).