2-(2-propylsulfonylethyl)cyclobutan-1-amine

C9H19NO2S — CID 106735337

IUPAC2-(2-propylsulfonylethyl)cyclobutan-1-amine
SMILESCCCS(=O)(=O)CCC1CCC1N
InChIInChI=1S/C9H19NO2S/c1-2-6-13(11,12)7-5-8-3-4-9(8)10/h8-9H,2-7,10H2,1H3
InChIKeyJETCPFOFGRJADA-UHFFFAOYSA-N
MW205.32 g/mol
LogP0.94
Rot. Bonds5

About 2-(2-propylsulfonylethyl)cyclobutan-1-amine

2-(2-propylsulfonylethyl)cyclobutan-1-amine (PubChem CID 106735337) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is 2-(2-propylsulfonylethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name2-(2-propylsulfonylethyl)cyclobutan-1-amine
PubChem CID106735337
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC Name2-(2-propylsulfonylethyl)cyclobutan-1-amine
SMILESCCCS(=O)(=O)CCC1CCC1N
InChIInChI=1S/C9H19NO2S/c1-2-6-13(11,12)7-5-8-3-4-9(8)10/h8-9H,2-7,10H2,1H3
InChIKeyJETCPFOFGRJADA-UHFFFAOYSA-N
XLogP0.94
TPSA60.16 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 ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-butylsulfonylethyl)cyclopentan-1-amine
CID 79581425
4-phenyl-2-(2-propylsulfonylethyl)cyclohexan-1-amine
CID 106727261
1-chloro-2-methyl-3-(2-propylsulfonylethyl)cyclopentane
CID 106732576
[2-(2-ethylsulfonylethyl)cyclobutyl]methanamine
CID 106735365
N,2-dimethyl-3-(2-propylsulfonylethyl)cyclopentan-1-amine
CID 106732386
1-propylsulfonylpropane
CID 11709
1-chloro-4-ethyl-2-(2-propylsulfonylethyl)cyclohexane
CID 106729101
N-[[2-(2-propylsulfonylethyl)cyclopentyl]methyl]propan-1-amine
CID 106735490
N-[[4-ethyl-2-(2-propylsulfonylethyl)cyclohexyl]methyl]cyclopropanamine
CID 106735608
2-(2-propylsulfonylethoxy)cyclohexan-1-amine
CID 106726998
N-methyl-4-propyl-2-(2-propylsulfonylethyl)cyclohexan-1-amine
CID 106727245
2-(3-ethylsulfonylpropyl)-4-propylcyclohexan-1-amine
CID 65097775

Frequently Asked Questions

What is the IUPAC name of 2-(2-propylsulfonylethyl)cyclobutan-1-amine?
The IUPAC name of 2-(2-propylsulfonylethyl)cyclobutan-1-amine (CID 106735337) is 2-(2-propylsulfonylethyl)cyclobutan-1-amine.
What is the SMILES notation for 2-(2-propylsulfonylethyl)cyclobutan-1-amine?
The canonical SMILES for 2-(2-propylsulfonylethyl)cyclobutan-1-amine is CCCS(=O)(=O)CCC1CCC1N.
What is the InChIKey of 2-(2-propylsulfonylethyl)cyclobutan-1-amine?
The InChIKey is JETCPFOFGRJADA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-2-6-13(11,12)7-5-8-3-4-9(8)10/h8-9H,2-7,10H2,1H3.
What are the key properties of 2-(2-propylsulfonylethyl)cyclobutan-1-amine?
2-(2-propylsulfonylethyl)cyclobutan-1-amine has a molecular weight of 205.32 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propylsulfonylethyl)cyclobutan-1-amine is sourced from PubChem (CID 106735337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).