N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide

C11H18N4O2 — CID 115774470

IUPACN-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide
SMILESCn1cnn(CC(=O)NC2CCCCC2)c1=O
InChIInChI=1S/C11H18N4O2/c1-14-8-12-15(11(14)17)7-10(16)13-9-5-3-2-4-6-9/h8-9H,2-7H2,1H3,(H,13,16)
InChIKeyUZSALDYLSJVANQ-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.03
Rot. Bonds3

About N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide

N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide (PubChem CID 115774470) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide
PubChem CID115774470
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC NameN-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide
SMILESCn1cnn(CC(=O)NC2CCCCC2)c1=O
InChIInChI=1S/C11H18N4O2/c1-14-8-12-15(11(14)17)7-10(16)13-9-5-3-2-4-6-9/h8-9H,2-7H2,1H3,(H,13,16)
InChIKeyUZSALDYLSJVANQ-UHFFFAOYSA-N
XLogP0.03
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide 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-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide?
The IUPAC name of N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide (CID 115774470) is N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide is Cn1cnn(CC(=O)NC2CCCCC2)c1=O.
What is the InChIKey of N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide?
The InChIKey is UZSALDYLSJVANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-14-8-12-15(11(14)17)7-10(16)13-9-5-3-2-4-6-9/h8-9H,2-7H2,1H3,(H,13,16).
What are the key properties of N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide?
N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide has a molecular weight of 238.29 g/mol, XLogP of 0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide is sourced from PubChem (CID 115774470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).