2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine

C12H26N2O2S — CID 81200983

IUPAC2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine
SMILESCC(CN)CS(=O)CC1CN(C(C)C)CCO1
InChIInChI=1S/C12H26N2O2S/c1-10(2)14-4-5-16-12(7-14)9-17(15)8-11(3)6-13/h10-12H,4-9,13H2,1-3H3
InChIKeyFAOXZISNZPVSFV-UHFFFAOYSA-N
MW262.42 g/mol
LogP0.44
Rot. Bonds6

About 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine

2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine (PubChem CID 81200983) has the molecular formula C12H26N2O2S and a molecular weight of 262.42 g/mol. Its IUPAC name is 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine
PubChem CID81200983
Molecular FormulaC12H26N2O2S
Molecular Weight262.42 g/mol
Exact Mass262.17
IUPAC Name2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine
SMILESCC(CN)CS(=O)CC1CN(C(C)C)CCO1
InChIInChI=1S/C12H26N2O2S/c1-10(2)14-4-5-16-12(7-14)9-17(15)8-11(3)6-13/h10-12H,4-9,13H2,1-3H3
InChIKeyFAOXZISNZPVSFV-UHFFFAOYSA-N
XLogP0.44
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.42
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-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

Related Compounds

2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propanoic acid
CID 64913956
4-propan-2-yl-2-propylmorpholine
CID 118118152
ethane;2-(methoxymethyl)-4-propan-2-ylmorpholine
CID 164585009
(2S)-4-propan-2-yl-2-(propan-2-yloxymethyl)morpholine
CID 174286235
5-bromo-2-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]aniline
CID 81185212
4-methyl-2-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]aniline
CID 81182878
2-(4-propan-2-ylmorpholin-2-yl)acetonitrile
CID 64534117
4-propan-2-yl-2-(2,2,2-trifluoroethyl)morpholine
CID 146614610
1-cyclopropyl-N-methyl-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethane-1,2-diamine
CID 116653050
4-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]piperazine-1-sulfonamide
CID 124565728
2-[(4-ethylmorpholin-2-yl)methylsulfinyl]propan-1-amine
CID 81187355
3-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrrolidine-2-carboxylic acid
CID 102784350

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine?
The IUPAC name of 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine (CID 81200983) is 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine.
What is the SMILES notation for 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine?
The canonical SMILES for 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine is CC(CN)CS(=O)CC1CN(C(C)C)CCO1.
What is the InChIKey of 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine?
The InChIKey is FAOXZISNZPVSFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2S/c1-10(2)14-4-5-16-12(7-14)9-17(15)8-11(3)6-13/h10-12H,4-9,13H2,1-3H3.
What are the key properties of 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine?
2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine has a molecular weight of 262.42 g/mol, XLogP of 0.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[(4-propan-2-ylmorpholin-2-yl)methylsulfinyl]propan-1-amine is sourced from PubChem (CID 81200983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).