N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide

C10H16N4OS — CID 709291

IUPACN-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
SMILESO=C(CSc1ncn[nH]1)NC1CCCCC1
InChIInChI=1S/C10H16N4OS/c15-9(6-16-10-11-7-12-14-10)13-8-4-2-1-3-5-8/h7-8H,1-6H2,(H,13,15)(H,11,12,14)
InChIKeyFKSCOZSUODMJCP-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.35
Rot. Bonds4

About N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide

N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide (PubChem CID 709291) has the molecular formula C10H16N4OS and a molecular weight of 240.33 g/mol. Its IUPAC name is N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
PubChem CID709291
Molecular FormulaC10H16N4OS
Molecular Weight240.33 g/mol
Exact Mass240.10
IUPAC NameN-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
SMILESO=C(CSc1ncn[nH]1)NC1CCCCC1
InChIInChI=1S/C10H16N4OS/c15-9(6-16-10-11-7-12-14-10)13-8-4-2-1-3-5-8/h7-8H,1-6H2,(H,13,15)(H,11,12,14)
InChIKeyFKSCOZSUODMJCP-UHFFFAOYSA-N
XLogP1.35
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)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-cycloheptyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 2352744
1-(piperidin-1-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone
CID 566413
N-cyclohexyl-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 855555
2-[(3-amino-1H-1,2,4-triazol-5-yl)sulfanyl]-N-cyclohexylacetamide
CID 2304193
2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclohexyl-N-ethylacetamide
CID 2339773
2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclohexyl-N-methylacetamide
CID 2383058
2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylcyclohexyl)acetamide
CID 3188532
2-(4-amino(1,2,4-triazol-3-ylthio))-N,N-dicyclohexylacetamide
CID 859358
N-cyclohexyl-N-ethyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
CID 2342823
N,N-dicyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
CID 2391135
N-bicyclo[2.2.1]hept-2-yl-2-(4H-1,2,4-triazol-3-ylthio)acetamide
CID 2978005
N-(2,3-dimethylcyclohexyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
CID 16264419

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide?
The IUPAC name of N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide (CID 709291) is N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide is O=C(CSc1ncn[nH]1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide?
The InChIKey is FKSCOZSUODMJCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4OS/c15-9(6-16-10-11-7-12-14-10)13-8-4-2-1-3-5-8/h7-8H,1-6H2,(H,13,15)(H,11,12,14).
What are the key properties of N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide?
N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide has a molecular weight of 240.33 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide is sourced from PubChem (CID 709291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).