2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine

C11H23NO2S — CID 107758417

IUPAC2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine
SMILESCC1OCCC1S(=O)CCNC(C)(C)C
InChIInChI=1S/C11H23NO2S/c1-9-10(5-7-14-9)15(13)8-6-12-11(2,3)4/h9-10,12H,5-8H2,1-4H3
InChIKeyACLSRVSOPXPBFT-UHFFFAOYSA-N
MW233.38 g/mol
LogP1.30
Rot. Bonds4

About 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine

2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine (PubChem CID 107758417) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine
PubChem CID107758417
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC Name2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine
SMILESCC1OCCC1S(=O)CCNC(C)(C)C
InChIInChI=1S/C11H23NO2S/c1-9-10(5-7-14-9)15(13)8-6-12-11(2,3)4/h9-10,12H,5-8H2,1-4H3
InChIKeyACLSRVSOPXPBFT-UHFFFAOYSA-N
XLogP1.30
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methyloxolan-3-yl)sulfinylethyl]cyclopropanamine
CID 107758266
3-(2-methyloxolan-3-yl)sulfinylpropan-1-amine
CID 58684813
3,3-dimethyl-1-(2-methyloxolan-3-yl)sulfinylbutan-2-one
CID 107764349
4-(2-methyloxolan-3-yl)sulfinylbutan-2-amine
CID 107758428
2,2-dimethyl-3-(2-methyloxolan-3-yl)sulfinylpropanoic acid
CID 107753126
2-methyl-N-[3-(2-methyloxolan-3-yl)sulfonylpropyl]propan-2-amine
CID 107756899
N-ethyl-1-(2-methyloxolan-3-yl)sulfinylbutan-2-amine
CID 107758395
N-[1-cyclopentyl-2-(2-methyloxolan-3-yl)sulfinylethyl]propan-1-amine
CID 107758464
2-[3-(2-methyloxolan-3-yl)sulfinylpropoxy]aniline
CID 107753497
ethyl 2-methyl-3-(2-methyloxolan-3-yl)sulfinylpropanoate
CID 107753074
3-[3-(2-methyloxolan-3-yl)sulfinylpropoxy]aniline
CID 107753471
3-[(2-methyloxolan-3-yl)sulfinylmethyl]benzoic acid
CID 107753094

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine (CID 107758417) is 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine is CC1OCCC1S(=O)CCNC(C)(C)C.
What is the InChIKey of 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine?
The InChIKey is ACLSRVSOPXPBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-9-10(5-7-14-9)15(13)8-6-12-11(2,3)4/h9-10,12H,5-8H2,1-4H3.
What are the key properties of 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine?
2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine has a molecular weight of 233.38 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(2-methyloxolan-3-yl)sulfinylethyl]propan-2-amine is sourced from PubChem (CID 107758417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).