2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide

C10H22N2O3S — CID 64850336

IUPAC2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide
SMILESCCOC1CC(NCCS(N)(=O)=O)C1(C)C
InChIInChI=1S/C10H22N2O3S/c1-4-15-9-7-8(10(9,2)3)12-5-6-16(11,13)14/h8-9,12H,4-7H2,1-3H3,(H2,11,13,14)
InChIKeyPRQAMPQIGVXLEH-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.07
Rot. Bonds6

About 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide

2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide (PubChem CID 64850336) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide.

Molecular Properties

Compound Name2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide
PubChem CID64850336
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide
SMILESCCOC1CC(NCCS(N)(=O)=O)C1(C)C
InChIInChI=1S/C10H22N2O3S/c1-4-15-9-7-8(10(9,2)3)12-5-6-16(11,13)14/h8-9,12H,4-7H2,1-3H3,(H2,11,13,14)
InChIKeyPRQAMPQIGVXLEH-UHFFFAOYSA-N
XLogP0.07
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide?
The IUPAC name of 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide (CID 64850336) is 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide.
What is the SMILES notation for 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide?
The canonical SMILES for 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide is CCOC1CC(NCCS(N)(=O)=O)C1(C)C.
What is the InChIKey of 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide?
The InChIKey is PRQAMPQIGVXLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-4-15-9-7-8(10(9,2)3)12-5-6-16(11,13)14/h8-9,12H,4-7H2,1-3H3,(H2,11,13,14).
What are the key properties of 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide?
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanesulfonamide is sourced from PubChem (CID 64850336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).