2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide

C11H14N6O — CID 882743

IUPAC2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)Cn1nnnc1N
InChIInChI=1S/C11H14N6O/c1-7-4-3-5-8(2)10(7)13-9(18)6-17-11(12)14-15-16-17/h3-5H,6H2,1-2H3,(H,13,18)(H2,12,14,16)
InChIKeyYDXNBDXNCAONFM-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.51
Rot. Bonds3

About 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide

2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide (PubChem CID 882743) has the molecular formula C11H14N6O and a molecular weight of 246.27 g/mol. Its IUPAC name is 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide
PubChem CID882743
Molecular FormulaC11H14N6O
Molecular Weight246.27 g/mol
Exact Mass246.12
IUPAC Name2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)Cn1nnnc1N
InChIInChI=1S/C11H14N6O/c1-7-4-3-5-8(2)10(7)13-9(18)6-17-11(12)14-15-16-17/h3-5H,6H2,1-2H3,(H,13,18)(H2,12,14,16)
InChIKeyYDXNBDXNCAONFM-UHFFFAOYSA-N
XLogP0.51
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)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

1-(1-Decyl-1H-tetrazol-5-yl)-3-(2,6-diisopropyl-phenyl)-urea
CID 10693847
1-(2,6-Diisopropyl-phenyl)-3-(1-dodecyl-1H-tetrazol-5-yl)-urea
CID 10766242
N-(2,5-dimethylphenyl)-3-(1H-tetrazol-1-yl)propanamide
CID 5296923
1-[4-(2,6-dimethylphenyl)piperazino]-2-(1H-1,2,4-triazol-1-yl)-1-ethanone
CID 4593836
N-(2,6-Dimethyl-phenyl)-2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-acetamide
CID 654446
N-(2-benzylphenyl)-2-(tetrazol-1-yl)acetamide
CID 2612876
N-(3-methylphenyl)-3-(1H-tetrazol-1-yl)propanamide
CID 5297177
1-{[(5-amino-1H-tetrazol-1-yl)acetyl](4-methylphenyl)amino}-N-(2-methylphenyl)cyclohexanecarboxamide
CID 1204935
Cambridge id 6816388
CID 829145
2-[5-amino-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2,6-diethylphenyl)acetamide
CID 2526633
2-[5-(2-aminophenyl)tetrazol-1-yl]-N-(4-methylphenyl)acetamide
CID 16013921
N-(2-ethyl-6-methylphenyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 24247232

Frequently Asked Questions

What is the IUPAC name of 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide?
The IUPAC name of 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide (CID 882743) is 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide?
The canonical SMILES for 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide is Cc1cccc(C)c1NC(=O)Cn1nnnc1N.
What is the InChIKey of 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide?
The InChIKey is YDXNBDXNCAONFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O/c1-7-4-3-5-8(2)10(7)13-9(18)6-17-11(12)14-15-16-17/h3-5H,6H2,1-2H3,(H,13,18)(H2,12,14,16).
What are the key properties of 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide?
2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide has a molecular weight of 246.27 g/mol, XLogP of 0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-aminotetrazol-1-yl)-N-(2,6-dimethylphenyl)acetamide is sourced from PubChem (CID 882743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).