N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide

C11H23NO3S — CID 130328349

IUPACN-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide
SMILESCC(C)(C)OCCS(=O)(=O)NCC1CCC1
InChIInChI=1S/C11H23NO3S/c1-11(2,3)15-7-8-16(13,14)12-9-10-5-4-6-10/h10,12H,4-9H2,1-3H3
InChIKeyFXBARFCPJIMGRE-UHFFFAOYSA-N
MW249.38 g/mol
LogP1.52
Rot. Bonds6

About N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide

N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide (PubChem CID 130328349) has the molecular formula C11H23NO3S and a molecular weight of 249.38 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide
PubChem CID130328349
Molecular FormulaC11H23NO3S
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC NameN-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide
SMILESCC(C)(C)OCCS(=O)(=O)NCC1CCC1
InChIInChI=1S/C11H23NO3S/c1-11(2,3)15-7-8-16(13,14)12-9-10-5-4-6-10/h10,12H,4-9H2,1-3H3
InChIKeyFXBARFCPJIMGRE-UHFFFAOYSA-N
XLogP1.52
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide?
The IUPAC name of N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide (CID 130328349) is N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide.
What is the SMILES notation for N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide?
The canonical SMILES for N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide is CC(C)(C)OCCS(=O)(=O)NCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide?
The InChIKey is FXBARFCPJIMGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3S/c1-11(2,3)15-7-8-16(13,14)12-9-10-5-4-6-10/h10,12H,4-9H2,1-3H3.
What are the key properties of N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide?
N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide has a molecular weight of 249.38 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-2-[(2-methylpropan-2-yl)oxy]ethanesulfonamide is sourced from PubChem (CID 130328349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).