N-(2-propan-2-ylsulfonylethyl)cyclobutanamine

C9H19NO2S — CID 106723621

IUPACN-(2-propan-2-ylsulfonylethyl)cyclobutanamine
SMILESCC(C)S(=O)(=O)CCNC1CCC1
InChIInChI=1S/C9H19NO2S/c1-8(2)13(11,12)7-6-10-9-4-3-5-9/h8-10H,3-7H2,1-2H3
InChIKeyRQZZRCPVOGTKOU-UHFFFAOYSA-N
MW205.32 g/mol
LogP0.95
Rot. Bonds5

About N-(2-propan-2-ylsulfonylethyl)cyclobutanamine

N-(2-propan-2-ylsulfonylethyl)cyclobutanamine (PubChem CID 106723621) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is N-(2-propan-2-ylsulfonylethyl)cyclobutanamine.

Molecular Properties

Compound NameN-(2-propan-2-ylsulfonylethyl)cyclobutanamine
PubChem CID106723621
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC NameN-(2-propan-2-ylsulfonylethyl)cyclobutanamine
SMILESCC(C)S(=O)(=O)CCNC1CCC1
InChIInChI=1S/C9H19NO2S/c1-8(2)13(11,12)7-6-10-9-4-3-5-9/h8-10H,3-7H2,1-2H3
InChIKeyRQZZRCPVOGTKOU-UHFFFAOYSA-N
XLogP0.95
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(2-propan-2-ylsulfonylethyl)piperidin-4-amine
CID 106723200
N-[2-(3-methylbutan-2-ylsulfonyl)ethyl]cyclopentanamine
CID 107757330
3-methyl-N-(2-propan-2-ylsulfonylethyl)cyclopentan-1-amine
CID 106724576
N-(2-propan-2-ylsulfonylethyl)-4-propylcyclohexan-1-amine
CID 106723458
3-methyl-N-[2-(3-methylbutan-2-ylsulfonyl)ethyl]cyclohexan-1-amine
CID 107757350
2-methyl-N-(2-propan-2-ylsulfonylethyl)cycloheptan-1-amine
CID 104926952
N-[2-(2-methylpropylsulfonyl)ethyl]cyclohexanamine
CID 106512958
2,3-dimethyl-N-(2-propan-2-ylsulfonylethyl)cyclopentan-1-amine
CID 106723838
1-(2-propan-2-ylsulfonylethyl)-N-propylpiperidin-3-amine
CID 106721523
N-(2-tert-butylsulfonylethyl)cyclopentanamine
CID 115625751
3-methyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine
CID 60920379
CID 58917870
CID 58917870

Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylsulfonylethyl)cyclobutanamine?
The IUPAC name of N-(2-propan-2-ylsulfonylethyl)cyclobutanamine (CID 106723621) is N-(2-propan-2-ylsulfonylethyl)cyclobutanamine.
What is the SMILES notation for N-(2-propan-2-ylsulfonylethyl)cyclobutanamine?
The canonical SMILES for N-(2-propan-2-ylsulfonylethyl)cyclobutanamine is CC(C)S(=O)(=O)CCNC1CCC1.
What is the InChIKey of N-(2-propan-2-ylsulfonylethyl)cyclobutanamine?
The InChIKey is RQZZRCPVOGTKOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-8(2)13(11,12)7-6-10-9-4-3-5-9/h8-10H,3-7H2,1-2H3.
What are the key properties of N-(2-propan-2-ylsulfonylethyl)cyclobutanamine?
N-(2-propan-2-ylsulfonylethyl)cyclobutanamine has a molecular weight of 205.32 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylsulfonylethyl)cyclobutanamine is sourced from PubChem (CID 106723621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).