4-(2-methylpentan-2-ylsulfonyl)morpholine

C10H21NO3S — CID 138601822

IUPAC4-(2-methylpentan-2-ylsulfonyl)morpholine
SMILESCCCC(C)(C)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C10H21NO3S/c1-4-5-10(2,3)15(12,13)11-6-8-14-9-7-11/h4-9H2,1-3H3
InChIKeyXXLOKQGLXPZENE-UHFFFAOYSA-N
MW235.35 g/mol
LogP1.23
Rot. Bonds4

About 4-(2-methylpentan-2-ylsulfonyl)morpholine

4-(2-methylpentan-2-ylsulfonyl)morpholine (PubChem CID 138601822) has the molecular formula C10H21NO3S and a molecular weight of 235.35 g/mol. Its IUPAC name is 4-(2-methylpentan-2-ylsulfonyl)morpholine.

Molecular Properties

Compound Name4-(2-methylpentan-2-ylsulfonyl)morpholine
PubChem CID138601822
Molecular FormulaC10H21NO3S
Molecular Weight235.35 g/mol
Exact Mass235.12
IUPAC Name4-(2-methylpentan-2-ylsulfonyl)morpholine
SMILESCCCC(C)(C)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C10H21NO3S/c1-4-5-10(2,3)15(12,13)11-6-8-14-9-7-11/h4-9H2,1-3H3
InChIKeyXXLOKQGLXPZENE-UHFFFAOYSA-N
XLogP1.23
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-methylsulfanylpropan-2-ylsulfonyl)morpholine
CID 139452580
2-morpholin-4-ylsulfonylpropane-2-sulfonic acid
CID 126656739
1-fluoro-2,3-dimethyl-3-morpholin-4-ylsulfonylpentane-2-sulfonic acid
CID 126656707
4-propylsulfonyl-1,4-oxazepane
CID 62067172
ethane;ethanesulfonic acid;morpholine-4-sulfonic acid
CID 175108255
4-[2-[(2-methylpropan-2-yl)oxy]ethylsulfonyl]morpholine
CID 118333607
1-(7-methyltetradecan-7-ylsulfonyl)piperidine
CID 146587233
2-methyl-2-(morpholin-4-ylmethyl)pentanal
CID 62276739
butane;bis(4-methylmorpholine)
CID 159010392
2-methyl-2-methylsulfonylpentane
CID 58153427
N-[(2S)-butan-2-yl]morpholine-4-sulfonamide
CID 95135939
2-methyl-2-morpholin-4-ylpentan-1-amine
CID 24706216

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpentan-2-ylsulfonyl)morpholine?
The IUPAC name of 4-(2-methylpentan-2-ylsulfonyl)morpholine (CID 138601822) is 4-(2-methylpentan-2-ylsulfonyl)morpholine.
What is the SMILES notation for 4-(2-methylpentan-2-ylsulfonyl)morpholine?
The canonical SMILES for 4-(2-methylpentan-2-ylsulfonyl)morpholine is CCCC(C)(C)S(=O)(=O)N1CCOCC1.
What is the InChIKey of 4-(2-methylpentan-2-ylsulfonyl)morpholine?
The InChIKey is XXLOKQGLXPZENE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3S/c1-4-5-10(2,3)15(12,13)11-6-8-14-9-7-11/h4-9H2,1-3H3.
What are the key properties of 4-(2-methylpentan-2-ylsulfonyl)morpholine?
4-(2-methylpentan-2-ylsulfonyl)morpholine has a molecular weight of 235.35 g/mol, XLogP of 1.23, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpentan-2-ylsulfonyl)morpholine is sourced from PubChem (CID 138601822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).