N,2-dimethyl-2-methylsulfanylpropan-1-amine

C6H15NS — CID 88989353

IUPACN,2-dimethyl-2-methylsulfanylpropan-1-amine
SMILESCNCC(C)(C)SC
InChIInChI=1S/C6H15NS/c1-6(2,8-4)5-7-3/h7H,5H2,1-4H3
InChIKeyGYICDXVIYONPKL-UHFFFAOYSA-N
MW133.26 g/mol
LogP1.35
Rot. Bonds3

About N,2-dimethyl-2-methylsulfanylpropan-1-amine

N,2-dimethyl-2-methylsulfanylpropan-1-amine (PubChem CID 88989353) has the molecular formula C6H15NS and a molecular weight of 133.26 g/mol. Its IUPAC name is N,2-dimethyl-2-methylsulfanylpropan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-2-methylsulfanylpropan-1-amine
PubChem CID88989353
Molecular FormulaC6H15NS
Molecular Weight133.26 g/mol
Exact Mass133.09
IUPAC NameN,2-dimethyl-2-methylsulfanylpropan-1-amine
SMILESCNCC(C)(C)SC
InChIInChI=1S/C6H15NS/c1-6(2,8-4)5-7-3/h7H,5H2,1-4H3
InChIKeyGYICDXVIYONPKL-UHFFFAOYSA-N
XLogP1.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.26
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,2-dimethyl-2-methylsulfanylpropan-1-amine 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,2-dimethyl-2-methylsulfanylpropan-1-amine?
The IUPAC name of N,2-dimethyl-2-methylsulfanylpropan-1-amine (CID 88989353) is N,2-dimethyl-2-methylsulfanylpropan-1-amine.
What is the SMILES notation for N,2-dimethyl-2-methylsulfanylpropan-1-amine?
The canonical SMILES for N,2-dimethyl-2-methylsulfanylpropan-1-amine is CNCC(C)(C)SC.
What is the InChIKey of N,2-dimethyl-2-methylsulfanylpropan-1-amine?
The InChIKey is GYICDXVIYONPKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NS/c1-6(2,8-4)5-7-3/h7H,5H2,1-4H3.
What are the key properties of N,2-dimethyl-2-methylsulfanylpropan-1-amine?
N,2-dimethyl-2-methylsulfanylpropan-1-amine has a molecular weight of 133.26 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-2-methylsulfanylpropan-1-amine is sourced from PubChem (CID 88989353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).