2-methylsulfinylethanamine;hydrochloride

C3H10ClNOS — CID 10464435

IUPAC2-methylsulfinylethanamine;hydrochloride
SMILESCS(=O)CCN.Cl
InChIInChI=1S/C3H9NOS.ClH/c1-6(5)3-2-4;/h2-4H2,1H3;1H
InChIKeyTWZPEKSMCMSPOB-UHFFFAOYSA-N
MW143.64 g/mol
LogP-0.25
Rot. Bonds2

About 2-methylsulfinylethanamine;hydrochloride

2-methylsulfinylethanamine;hydrochloride (PubChem CID 10464435) has the molecular formula C3H10ClNOS and a molecular weight of 143.64 g/mol. Its IUPAC name is 2-methylsulfinylethanamine;hydrochloride.

Molecular Properties

Compound Name2-methylsulfinylethanamine;hydrochloride
PubChem CID10464435
Molecular FormulaC3H10ClNOS
Molecular Weight143.64 g/mol
Exact Mass143.02
IUPAC Name2-methylsulfinylethanamine;hydrochloride
SMILESCS(=O)CCN.Cl
InChIInChI=1S/C3H9NOS.ClH/c1-6(5)3-2-4;/h2-4H2,1H3;1H
InChIKeyTWZPEKSMCMSPOB-UHFFFAOYSA-N
XLogP-0.25
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.64
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Methylsulfonyl)ethanamine
CID 4340561
2-Methylsulfonothioylethanamine
CID 49864489
2-(Methylsulfinyl)ethanamine
CID 4347855
2-(Methylsulfanyl)ethan-1-amine hydrochloride
CID 22722792
3-[(S)-methylsulfinyl]propan-1-amine
CID 51534039
2-Methanesulfinylpropan-1-amine
CID 53806283
3-Methanesulfinylpropan-1-amine hydrochloride
CID 88921732
(2-Aminoethyl)(methyl)(methylimino)-lambda6-sulfanone
CID 119056976
3-Methanesulfinylpropan-1-amine
CID 21259994
Ethanamine, 2-(methylsulfonyl)-, hydrochloride (1:1)
CID 17749886
(2-Aminoethyl)(imino)methyl-lambda6-sulfanone dihydrochloride
CID 138040850
Aminoethylsulfinylchlorid
CID 129637606

Frequently Asked Questions

What is the IUPAC name of 2-methylsulfinylethanamine;hydrochloride?
The IUPAC name of 2-methylsulfinylethanamine;hydrochloride (CID 10464435) is 2-methylsulfinylethanamine;hydrochloride.
What is the SMILES notation for 2-methylsulfinylethanamine;hydrochloride?
The canonical SMILES for 2-methylsulfinylethanamine;hydrochloride is CS(=O)CCN.Cl.
What is the InChIKey of 2-methylsulfinylethanamine;hydrochloride?
The InChIKey is TWZPEKSMCMSPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NOS.ClH/c1-6(5)3-2-4;/h2-4H2,1H3;1H.
What are the key properties of 2-methylsulfinylethanamine;hydrochloride?
2-methylsulfinylethanamine;hydrochloride has a molecular weight of 143.64 g/mol, XLogP of -0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfinylethanamine;hydrochloride is sourced from PubChem (CID 10464435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).