2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol

C9H19NOS — CID 60883838

IUPAC2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol
SMILESCN(CC(C)(C)O)C1CCSC1
InChIInChI=1S/C9H19NOS/c1-9(2,11)7-10(3)8-4-5-12-6-8/h8,11H,4-7H2,1-3H3
InChIKeyIPFOGIZORFPJNI-UHFFFAOYSA-N
MW189.32 g/mol
LogP1.19
Rot. Bonds3

About 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol

2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol (PubChem CID 60883838) has the molecular formula C9H19NOS and a molecular weight of 189.32 g/mol. Its IUPAC name is 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol
PubChem CID60883838
Molecular FormulaC9H19NOS
Molecular Weight189.32 g/mol
Exact Mass189.12
IUPAC Name2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol
SMILESCN(CC(C)(C)O)C1CCSC1
InChIInChI=1S/C9H19NOS/c1-9(2,11)7-10(3)8-4-5-12-6-8/h8,11H,4-7H2,1-3H3
InChIKeyIPFOGIZORFPJNI-UHFFFAOYSA-N
XLogP1.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.32
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol 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-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol?
The IUPAC name of 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol (CID 60883838) is 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol.
What is the SMILES notation for 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol?
The canonical SMILES for 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol is CN(CC(C)(C)O)C1CCSC1.
What is the InChIKey of 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol?
The InChIKey is IPFOGIZORFPJNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NOS/c1-9(2,11)7-10(3)8-4-5-12-6-8/h8,11H,4-7H2,1-3H3.
What are the key properties of 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol?
2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol has a molecular weight of 189.32 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[methyl(thiolan-3-yl)amino]propan-2-ol is sourced from PubChem (CID 60883838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).