(3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one

C11H21NO2S — CID 70315481

IUPAC(3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one
SMILESCSCC[C@H](C)CC(=O)N1CCOCC1
InChIInChI=1S/C11H21NO2S/c1-10(3-8-15-2)9-11(13)12-4-6-14-7-5-12/h10H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyINHKNWMZNRBAQV-JTQLQIEISA-N
MW231.36 g/mol
LogP1.62
Rot. Bonds5

About (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one

(3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one (PubChem CID 70315481) has the molecular formula C11H21NO2S and a molecular weight of 231.36 g/mol. Its IUPAC name is (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one.

Molecular Properties

Compound Name(3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one
PubChem CID70315481
Molecular FormulaC11H21NO2S
Molecular Weight231.36 g/mol
Exact Mass231.13
IUPAC Name(3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one
SMILESCSCC[C@H](C)CC(=O)N1CCOCC1
InChIInChI=1S/C11H21NO2S/c1-10(3-8-15-2)9-11(13)12-4-6-14-7-5-12/h10H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyINHKNWMZNRBAQV-JTQLQIEISA-N
XLogP1.62
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.36
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one 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

1-(4-Methylpiperidin-1-yl)-2-(2-morpholin-4-ylethylsulfanyl)ethanone
CID 75360759
N-(2-methoxyethyl)-3-{1-[3-(methylthio)propyl]-4-piperidinyl}propanamide
CID 25310534
3-Methoxy-4-morpholinocarbonylmethylthiolane
CID 129800565
(3S)-3-methyl-1-morpholin-4-ylpentan-1-one
CID 134970138
3-Butylsulfanyl-2-methyl-1-morpholin-4-ylpropan-1-one
CID 23534468
1-(2-Ethoxyethyl)-3-sulfanylpiperidin-2-one
CID 23652255
1-Morpholin-4-yl-5-sulfanylpentan-1-one
CID 54236383
(2-Propan-2-ylmorpholin-4-yl)-(thietan-3-yl)methanone
CID 58469011
4-Tert-butylsulfanyl-1-morpholin-4-ylbutan-1-one
CID 59176720
CID 59324965
CID 59324965
4-Ethylsulfanyl-1-morpholin-4-ylbutan-1-one
CID 67950660
1-Morpholin-4-yl-4-propan-2-ylsulfanylbutan-1-one
CID 70306394

Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one?
The IUPAC name of (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one (CID 70315481) is (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one.
What is the SMILES notation for (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one?
The canonical SMILES for (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one is CSCC[C@H](C)CC(=O)N1CCOCC1.
What is the InChIKey of (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one?
The InChIKey is INHKNWMZNRBAQV-JTQLQIEISA-N. The full InChI is InChI=1S/C11H21NO2S/c1-10(3-8-15-2)9-11(13)12-4-6-14-7-5-12/h10H,3-9H2,1-2H3/t10-/m0/s1.
What are the key properties of (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one?
(3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one has a molecular weight of 231.36 g/mol, XLogP of 1.62, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-5-methylsulfanyl-1-morpholin-4-ylpentan-1-one is sourced from PubChem (CID 70315481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).