1-(2-methylsulfinylethyl)azetidin-3-amine

C6H14N2OS — CID 84651469

IUPAC1-(2-methylsulfinylethyl)azetidin-3-amine
SMILESCS(=O)CCN1CC(N)C1
InChIInChI=1S/C6H14N2OS/c1-10(9)3-2-8-4-6(7)5-8/h6H,2-5,7H2,1H3
InChIKeyTVOAIYDTXQVONO-UHFFFAOYSA-N
MW162.26 g/mol
LogP-0.99
Rot. Bonds3

About 1-(2-methylsulfinylethyl)azetidin-3-amine

1-(2-methylsulfinylethyl)azetidin-3-amine (PubChem CID 84651469) has the molecular formula C6H14N2OS and a molecular weight of 162.26 g/mol. Its IUPAC name is 1-(2-methylsulfinylethyl)azetidin-3-amine.

Molecular Properties

Compound Name1-(2-methylsulfinylethyl)azetidin-3-amine
PubChem CID84651469
Molecular FormulaC6H14N2OS
Molecular Weight162.26 g/mol
Exact Mass162.08
IUPAC Name1-(2-methylsulfinylethyl)azetidin-3-amine
SMILESCS(=O)CCN1CC(N)C1
InChIInChI=1S/C6H14N2OS/c1-10(9)3-2-8-4-6(7)5-8/h6H,2-5,7H2,1H3
InChIKeyTVOAIYDTXQVONO-UHFFFAOYSA-N
XLogP-0.99
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.26
LogP ≤ 5-0.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(Azetidin-3-yl)-1,4-thiazinane 1-oxide
CID 62783701
N-[3-(Methylsulfonyl)propyl]-3-azetidinamine
CID 65957823
1-methyl-N-(3-methylsulfonylpropyl)azetidin-3-amine
CID 90078049
1-N-(1,1-dioxothietan-3-yl)propane-1,2-diamine
CID 156339489
2-Methyl-1-(2-methylsulfonylethyl)azetidin-3-amine
CID 170709017
3-methyl-N-(2-methylsulfinylethyl)azetidin-3-amine
CID 170709084
2-Methyl-1-(2-methylsulfonylethyl)azetidin-3-amine;dihydrochloride
CID 176890270
1-(3-Methylsulfonylpropyl)azetidin-3-amine
CID 63760695
1-(2-Ethylsulfonylethyl)azetidin-3-amine
CID 63760901
1-(2-Methylsulfonylethyl)azetidin-3-amine
CID 63760915
1-(3-Ethylsulfonylpropyl)azetidin-3-amine
CID 65097089
1-(3-Methylsulfanylpropyl)azetidin-3-amine
CID 65244266

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylsulfinylethyl)azetidin-3-amine?
The IUPAC name of 1-(2-methylsulfinylethyl)azetidin-3-amine (CID 84651469) is 1-(2-methylsulfinylethyl)azetidin-3-amine.
What is the SMILES notation for 1-(2-methylsulfinylethyl)azetidin-3-amine?
The canonical SMILES for 1-(2-methylsulfinylethyl)azetidin-3-amine is CS(=O)CCN1CC(N)C1.
What is the InChIKey of 1-(2-methylsulfinylethyl)azetidin-3-amine?
The InChIKey is TVOAIYDTXQVONO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2OS/c1-10(9)3-2-8-4-6(7)5-8/h6H,2-5,7H2,1H3.
What are the key properties of 1-(2-methylsulfinylethyl)azetidin-3-amine?
1-(2-methylsulfinylethyl)azetidin-3-amine has a molecular weight of 162.26 g/mol, XLogP of -0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylsulfinylethyl)azetidin-3-amine is sourced from PubChem (CID 84651469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).