2-methyl-2-methylsulfinothioylpropan-1-amine

C5H13NS2 — CID 155654845

IUPAC2-methyl-2-methylsulfinothioylpropan-1-amine
SMILESCS(=S)C(C)(C)CN
InChIInChI=1S/C5H13NS2/c1-5(2,4-6)8(3)7/h4,6H2,1-3H3
InChIKeySHMQVOVNDMCHLW-UHFFFAOYSA-N
MW151.30 g/mol
LogP0.43
Rot. Bonds2

About 2-methyl-2-methylsulfinothioylpropan-1-amine

2-methyl-2-methylsulfinothioylpropan-1-amine (PubChem CID 155654845) has the molecular formula C5H13NS2 and a molecular weight of 151.30 g/mol. Its IUPAC name is 2-methyl-2-methylsulfinothioylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-2-methylsulfinothioylpropan-1-amine
PubChem CID155654845
Molecular FormulaC5H13NS2
Molecular Weight151.30 g/mol
Exact Mass151.05
IUPAC Name2-methyl-2-methylsulfinothioylpropan-1-amine
SMILESCS(=S)C(C)(C)CN
InChIInChI=1S/C5H13NS2/c1-5(2,4-6)8(3)7/h4,6H2,1-3H3
InChIKeySHMQVOVNDMCHLW-UHFFFAOYSA-N
XLogP0.43
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.30
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Methylsulfanyl)propan-1-amine
CID 22450265
2-(tert-Butylthio)ethanamine
CID 2774519
2-(tert-Butyldithio)ethanamine
CID 434077
2-Methyl-2-(methylsulfanyl)propan-1-amine
CID 20763153
2,3-Bis(methylsulfanyl)propan-1-amine
CID 54283588
Methyl 3-aminopropanedithioate
CID 57004228
2-Methylsulfanylpropylazanide
CID 58013167
N,2-dimethyl-2-methylsulfinothioylpropan-1-amine
CID 59440096
2-Methyl-2-(methyldisulfanyl)propan-1-amine
CID 87176994
(2R)-2-methylsulfanylpropan-1-amine
CID 87578919
(2S)-2-methylsulfanylpropan-1-amine
CID 87579568
Methyl 3-amino-2-methylpropanedithioate
CID 87802389

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-methylsulfinothioylpropan-1-amine?
The IUPAC name of 2-methyl-2-methylsulfinothioylpropan-1-amine (CID 155654845) is 2-methyl-2-methylsulfinothioylpropan-1-amine.
What is the SMILES notation for 2-methyl-2-methylsulfinothioylpropan-1-amine?
The canonical SMILES for 2-methyl-2-methylsulfinothioylpropan-1-amine is CS(=S)C(C)(C)CN.
What is the InChIKey of 2-methyl-2-methylsulfinothioylpropan-1-amine?
The InChIKey is SHMQVOVNDMCHLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NS2/c1-5(2,4-6)8(3)7/h4,6H2,1-3H3.
What are the key properties of 2-methyl-2-methylsulfinothioylpropan-1-amine?
2-methyl-2-methylsulfinothioylpropan-1-amine has a molecular weight of 151.30 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-methylsulfinothioylpropan-1-amine is sourced from PubChem (CID 155654845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).