1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine

C10H21NO2S — CID 106724457

IUPAC1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine
SMILESCC(C)S(=O)(=O)CCNC1(C)CCC1
InChIInChI=1S/C10H21NO2S/c1-9(2)14(12,13)8-7-11-10(3)5-4-6-10/h9,11H,4-8H2,1-3H3
InChIKeyLXUXSXWXKPTDPZ-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.34
Rot. Bonds5

About 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine

1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine (PubChem CID 106724457) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine
PubChem CID106724457
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC Name1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine
SMILESCC(C)S(=O)(=O)CCNC1(C)CCC1
InChIInChI=1S/C10H21NO2S/c1-9(2)14(12,13)8-7-11-10(3)5-4-6-10/h9,11H,4-8H2,1-3H3
InChIKeyLXUXSXWXKPTDPZ-UHFFFAOYSA-N
XLogP1.34
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-propan-2-ylsulfonylethylamino)cyclopropane-1-carboxylic acid
CID 106727583
N-[(1-ethylcyclopentyl)methyl]-2-propan-2-ylsulfonylethanamine
CID 114125061
1-methyl-N-(2-propylsulfonylethyl)cyclohexan-1-amine
CID 106723533
N-[(3-methyloxetan-3-yl)methyl]-2-propan-2-ylsulfonylethanamine
CID 106724002
2-propan-2-ylsulfonyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine
CID 106723973
N-(2-propan-2-ylsulfonylethyl)propan-1-amine
CID 64676405
1-methyl-N-(2-propylsulfonylethyl)cyclopropan-1-amine
CID 106724453
1-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 115877016
N-(2-propan-2-ylsulfonylethyl)cyclobutanamine
CID 106723621
2-chloro-3-methyl-N-(2-propan-2-ylsulfonylethyl)butan-1-amine
CID 106731318
N-[[1-(2-propan-2-ylsulfonylethyl)cyclopentyl]methyl]ethanamine
CID 106729871
2,2,2-trifluoro-N-(2-propan-2-ylsulfonylethyl)ethanamine
CID 106513185

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine?
The IUPAC name of 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine (CID 106724457) is 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine.
What is the SMILES notation for 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine?
The canonical SMILES for 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine is CC(C)S(=O)(=O)CCNC1(C)CCC1.
What is the InChIKey of 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine?
The InChIKey is LXUXSXWXKPTDPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-9(2)14(12,13)8-7-11-10(3)5-4-6-10/h9,11H,4-8H2,1-3H3.
What are the key properties of 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine?
1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine has a molecular weight of 219.35 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-propan-2-ylsulfonylethyl)cyclobutan-1-amine is sourced from PubChem (CID 106724457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).