2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine

C11H24N2OS — CID 63964280

IUPAC2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine
SMILESCSCC(C)CNCCN1CCOCC1
InChIInChI=1S/C11H24N2OS/c1-11(10-15-2)9-12-3-4-13-5-7-14-8-6-13/h11-12H,3-10H2,1-2H3
InChIKeyFTSDRZOQNHYJAF-UHFFFAOYSA-N
MW232.39 g/mol
LogP0.91
Rot. Bonds7

About 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine

2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine (PubChem CID 63964280) has the molecular formula C11H24N2OS and a molecular weight of 232.39 g/mol. Its IUPAC name is 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine
PubChem CID63964280
Molecular FormulaC11H24N2OS
Molecular Weight232.39 g/mol
Exact Mass232.16
IUPAC Name2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine
SMILESCSCC(C)CNCCN1CCOCC1
InChIInChI=1S/C11H24N2OS/c1-11(10-15-2)9-12-3-4-13-5-7-14-8-6-13/h11-12H,3-10H2,1-2H3
InChIKeyFTSDRZOQNHYJAF-UHFFFAOYSA-N
XLogP0.91
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.39
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-morpholin-4-ylethylamino)propan-2-ol
CID 43393555
2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine
CID 64568943
2-methyl-N'-(2-morpholin-4-ylethyl)butane-1,4-diamine
CID 114987350
4-methyl-N-(2-morpholin-4-ylethyl)pentan-1-amine
CID 61044634
2-N-cyclopropyl-2-N-methyl-1-N-(2-morpholin-4-ylethyl)propane-1,2-diamine
CID 114133400
(2R)-N-(2-morpholin-4-ylethyl)-2-phenylpropan-1-amine
CID 28617584
CID 59303713
CID 59303713
4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine
CID 106121816
2-methyl-3-pyrrolidin-1-yl-N-(2-pyrrolidin-1-ylethyl)propan-1-amine
CID 107911598
2-(2-morpholin-4-ylethylamino)acetonitrile
CID 28583059
N-(2-morpholin-4-ylethyl)-1-(propylamino)propane-2-sulfonamide
CID 107088893
N-(3-methylbutan-2-yl)-2-(2-morpholin-4-ylethylamino)acetamide
CID 60687185

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine?
The IUPAC name of 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine (CID 63964280) is 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine?
The canonical SMILES for 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine is CSCC(C)CNCCN1CCOCC1.
What is the InChIKey of 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine?
The InChIKey is FTSDRZOQNHYJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2OS/c1-11(10-15-2)9-12-3-4-13-5-7-14-8-6-13/h11-12H,3-10H2,1-2H3.
What are the key properties of 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine?
2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine has a molecular weight of 232.39 g/mol, XLogP of 0.91, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine is sourced from PubChem (CID 63964280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).