N-[(2S)-butan-2-yl]morpholine-4-sulfonamide

C8H18N2O3S — CID 95135939

IUPACN-[(2S)-butan-2-yl]morpholine-4-sulfonamide
SMILESCC[C@H](C)NS(=O)(=O)N1CCOCC1
InChIInChI=1S/C8H18N2O3S/c1-3-8(2)9-14(11,12)10-4-6-13-7-5-10/h8-9H,3-7H2,1-2H3/t8-/m0/s1
InChIKeyVBFSLRGDGPHZOY-QMMMGPOBSA-N
MW222.31 g/mol
LogP-0.05
Rot. Bonds4

About N-[(2S)-butan-2-yl]morpholine-4-sulfonamide

N-[(2S)-butan-2-yl]morpholine-4-sulfonamide (PubChem CID 95135939) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is N-[(2S)-butan-2-yl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[(2S)-butan-2-yl]morpholine-4-sulfonamide
PubChem CID95135939
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC NameN-[(2S)-butan-2-yl]morpholine-4-sulfonamide
SMILESCC[C@H](C)NS(=O)(=O)N1CCOCC1
InChIInChI=1S/C8H18N2O3S/c1-3-8(2)9-14(11,12)10-4-6-13-7-5-10/h8-9H,3-7H2,1-2H3/t8-/m0/s1
InChIKeyVBFSLRGDGPHZOY-QMMMGPOBSA-N
XLogP-0.05
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-chlorobutan-2-yl)morpholine-4-sulfonamide
CID 65033713
N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-sulfonamide
CID 115754877
N-(1-chloro-3-methylbutan-2-yl)morpholine-4-sulfonamide
CID 79267830
(2S)-3-methyl-2-(morpholin-4-ylsulfonylamino)butanoic acid
CID 10445626
N-butan-2-yl-2,6-dimethylmorpholine-4-sulfonamide
CID 42936366
N-(1-cyanoethyl)morpholine-4-sulfonamide
CID 61123447
(2S)-2-(morpholin-4-ylsulfonylamino)propanoic acid
CID 10354183
N-[1-(4-ethylphenyl)ethyl]morpholine-4-sulfonamide
CID 47141626
N-(1-aminohexan-2-yl)morpholine-4-sulfonamide
CID 80696386
N-(1-thiophen-2-ylpropyl)morpholine-4-sulfonamide
CID 47306222
N-[2-methyl-3-(methylamino)propyl]morpholine-4-sulfonamide
CID 115302914
N-[3-(propan-2-ylamino)propyl]morpholine-4-sulfonamide
CID 43606820

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-butan-2-yl]morpholine-4-sulfonamide?
The IUPAC name of N-[(2S)-butan-2-yl]morpholine-4-sulfonamide (CID 95135939) is N-[(2S)-butan-2-yl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[(2S)-butan-2-yl]morpholine-4-sulfonamide?
The canonical SMILES for N-[(2S)-butan-2-yl]morpholine-4-sulfonamide is CC[C@H](C)NS(=O)(=O)N1CCOCC1.
What is the InChIKey of N-[(2S)-butan-2-yl]morpholine-4-sulfonamide?
The InChIKey is VBFSLRGDGPHZOY-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-3-8(2)9-14(11,12)10-4-6-13-7-5-10/h8-9H,3-7H2,1-2H3/t8-/m0/s1.
What are the key properties of N-[(2S)-butan-2-yl]morpholine-4-sulfonamide?
N-[(2S)-butan-2-yl]morpholine-4-sulfonamide has a molecular weight of 222.31 g/mol, XLogP of -0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-butan-2-yl]morpholine-4-sulfonamide is sourced from PubChem (CID 95135939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).