Skip to content

2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide

C11H24N2OS — CID 176618081

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide
SMILESCC(SC(C)(C)C)C(=O)NCCN(C)C
InChIInChI=1S/C11H24N2OS/c1-9(15-11(2,3)4)10(14)12-7-8-13(5)6/h9H,7-8H2,1-6H3,(H,12,14)
InChIKeyFHLMWSFLSMGBIJ-UHFFFAOYSA-N
MW232.39 g/mol
LogP1.58
Rot. Bonds5

About 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide

2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide (PubChem CID 176618081) has the molecular formula C11H24N2OS and a molecular weight of 232.39 g/mol. Its IUPAC name is 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide.

Molecular Properties

Compound Name2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide
PubChem CID176618081
Molecular FormulaC11H24N2OS
Molecular Weight232.39 g/mol
Exact Mass232.16
IUPAC Name2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide
SMILESCC(SC(C)(C)C)C(=O)NCCN(C)C
InChIInChI=1S/C11H24N2OS/c1-9(15-11(2,3)4)10(14)12-7-8-13(5)6/h9H,7-8H2,1-6H3,(H,12,14)
InChIKeyFHLMWSFLSMGBIJ-UHFFFAOYSA-N
XLogP1.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.39
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]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 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide?
The IUPAC name of 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide (CID 176618081) is 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide.
What is the SMILES notation for 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide?
The canonical SMILES for 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide is CC(SC(C)(C)C)C(=O)NCCN(C)C.
What is the InChIKey of 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide?
The InChIKey is FHLMWSFLSMGBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2OS/c1-9(15-11(2,3)4)10(14)12-7-8-13(5)6/h9H,7-8H2,1-6H3,(H,12,14).
What are the key properties of 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide?
2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide has a molecular weight of 232.39 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butylsulfanyl-N-[2-(dimethylamino)ethyl]propanamide is sourced from PubChem (CID 176618081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.