N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide

C12H19N3O2S — CID 17438437

IUPACN-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
SMILESCC(C)c1nnc(SCC(=O)NC2CCCC2)o1
InChIInChI=1S/C12H19N3O2S/c1-8(2)11-14-15-12(17-11)18-7-10(16)13-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,13,16)
InChIKeyXWVCFNAIYLNNRX-UHFFFAOYSA-N
MW269.37 g/mol
LogP2.34
Rot. Bonds5

About N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide

N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide (PubChem CID 17438437) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
PubChem CID17438437
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC NameN-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
SMILESCC(C)c1nnc(SCC(=O)NC2CCCC2)o1
InChIInChI=1S/C12H19N3O2S/c1-8(2)11-14-15-12(17-11)18-7-10(16)13-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,13,16)
InChIKeyXWVCFNAIYLNNRX-UHFFFAOYSA-N
XLogP2.34
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]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-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
The IUPAC name of N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide (CID 17438437) is N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide is CC(C)c1nnc(SCC(=O)NC2CCCC2)o1.
What is the InChIKey of N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
The InChIKey is XWVCFNAIYLNNRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-8(2)11-14-15-12(17-11)18-7-10(16)13-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,13,16).
What are the key properties of N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide?
N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide has a molecular weight of 269.37 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide is sourced from PubChem (CID 17438437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).