(2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide

C10H17N3O2S — CID 9373940

IUPAC(2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide
SMILESCc1nnc(S[C@@H](C)C(=O)NCC(C)C)o1
InChIInChI=1S/C10H17N3O2S/c1-6(2)5-11-9(14)7(3)16-10-13-12-8(4)15-10/h6-7H,5H2,1-4H3,(H,11,14)/t7-/m0/s1
InChIKeyHZOIIEZZHJIVNN-ZETCQYMHSA-N
MW243.33 g/mol
LogP1.63
Rot. Bonds5

About (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide

(2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide (PubChem CID 9373940) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name(2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide
PubChem CID9373940
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC Name(2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide
SMILESCc1nnc(S[C@@H](C)C(=O)NCC(C)C)o1
InChIInChI=1S/C10H17N3O2S/c1-6(2)5-11-9(14)7(3)16-10-13-12-8(4)15-10/h6-7H,5H2,1-4H3,(H,11,14)/t7-/m0/s1
InChIKeyHZOIIEZZHJIVNN-ZETCQYMHSA-N
XLogP1.63
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide 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 (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide?
The IUPAC name of (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide (CID 9373940) is (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide.
What is the SMILES notation for (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide?
The canonical SMILES for (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide is Cc1nnc(S[C@@H](C)C(=O)NCC(C)C)o1.
What is the InChIKey of (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide?
The InChIKey is HZOIIEZZHJIVNN-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H17N3O2S/c1-6(2)5-11-9(14)7(3)16-10-13-12-8(4)15-10/h6-7H,5H2,1-4H3,(H,11,14)/t7-/m0/s1.
What are the key properties of (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide?
(2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide has a molecular weight of 243.33 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 9373940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).