2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide

C10H23NO3S — CID 95762226

IUPAC2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide
SMILESCOCCS(=O)(=O)N[C@H](C)CCC(C)C
InChIInChI=1S/C10H23NO3S/c1-9(2)5-6-10(3)11-15(12,13)8-7-14-4/h9-11H,5-8H2,1-4H3/t10-/m1/s1
InChIKeyZZOHWBWMFZVNTR-SNVBAGLBSA-N
MW237.36 g/mol
LogP1.38
Rot. Bonds8

About 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide

2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide (PubChem CID 95762226) has the molecular formula C10H23NO3S and a molecular weight of 237.36 g/mol. Its IUPAC name is 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide.

Molecular Properties

Compound Name2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide
PubChem CID95762226
Molecular FormulaC10H23NO3S
Molecular Weight237.36 g/mol
Exact Mass237.14
IUPAC Name2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide
SMILESCOCCS(=O)(=O)N[C@H](C)CCC(C)C
InChIInChI=1S/C10H23NO3S/c1-9(2)5-6-10(3)11-15(12,13)8-7-14-4/h9-11H,5-8H2,1-4H3/t10-/m1/s1
InChIKeyZZOHWBWMFZVNTR-SNVBAGLBSA-N
XLogP1.38
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.36
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 95358214
CID 95358214

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide?
The IUPAC name of 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide (CID 95762226) is 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide.
What is the SMILES notation for 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide?
The canonical SMILES for 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide is COCCS(=O)(=O)N[C@H](C)CCC(C)C.
What is the InChIKey of 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide?
The InChIKey is ZZOHWBWMFZVNTR-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H23NO3S/c1-9(2)5-6-10(3)11-15(12,13)8-7-14-4/h9-11H,5-8H2,1-4H3/t10-/m1/s1.
What are the key properties of 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide?
2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide has a molecular weight of 237.36 g/mol, XLogP of 1.38, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(2R)-5-methylhexan-2-yl]ethanesulfonamide is sourced from PubChem (CID 95762226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).