2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine

C15H32N2OS — CID 112665944

IUPAC2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
SMILESCSCC(C)N(C)CC1CCC(CNC(C)(C)C)O1
InChIInChI=1S/C15H32N2OS/c1-12(11-19-6)17(5)10-14-8-7-13(18-14)9-16-15(2,3)4/h12-14,16H,7-11H2,1-6H3
InChIKeyWBXGFSZGKAEJMS-UHFFFAOYSA-N
MW288.50 g/mol
LogP2.61
Rot. Bonds7

About 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine

2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine (PubChem CID 112665944) has the molecular formula C15H32N2OS and a molecular weight of 288.50 g/mol. Its IUPAC name is 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
PubChem CID112665944
Molecular FormulaC15H32N2OS
Molecular Weight288.50 g/mol
Exact Mass288.22
IUPAC Name2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
SMILESCSCC(C)N(C)CC1CCC(CNC(C)(C)C)O1
InChIInChI=1S/C15H32N2OS/c1-12(11-19-6)17(5)10-14-8-7-13(18-14)9-16-15(2,3)4/h12-14,16H,7-11H2,1-6H3
InChIKeyWBXGFSZGKAEJMS-UHFFFAOYSA-N
XLogP2.61
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.50
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-1-methylsulfanylpropan-2-amine
CID 112665945
2-methyl-N-[[5-[[methyl(propyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62417002
N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine
CID 62418705
N-methyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]-1-methylsulfanylbutan-2-amine
CID 115987811
N-[[5-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 62426631
N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylaniline
CID 62440143
N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 62459646
N,4-dimethyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]pentan-2-amine
CID 62461429
1-N-tert-butyl-3-N-methyl-3-N-(oxolan-2-ylmethyl)butane-1,3-diamine
CID 62436071
N-tert-butyl-N',2,2-trimethyl-N'-(1-methylsulfanylpropan-2-yl)propane-1,3-diamine
CID 112664988
N-cyclopropyl-N'-methyl-N'-(1-methylsulfanylpropan-2-yl)ethane-1,2-diamine
CID 112661279
N-[[5-(aminomethyl)oxolan-2-yl]methyl]-N-methylbutan-2-amine
CID 62419353

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine (CID 112665944) is 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine is CSCC(C)N(C)CC1CCC(CNC(C)(C)C)O1.
What is the InChIKey of 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine?
The InChIKey is WBXGFSZGKAEJMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2OS/c1-12(11-19-6)17(5)10-14-8-7-13(18-14)9-16-15(2,3)4/h12-14,16H,7-11H2,1-6H3.
What are the key properties of 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine?
2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine has a molecular weight of 288.50 g/mol, XLogP of 2.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 112665944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).