1-amino-2-[methyl(sulfino)amino]ethane

C3H10N2O2S — CID 57089331

IUPAC1-amino-2-[methyl(sulfino)amino]ethane
SMILESCN(CCN)S(=O)O
InChIInChI=1S/C3H10N2O2S/c1-5(3-2-4)8(6)7/h2-4H2,1H3,(H,6,7)
InChIKeyGYBZEGRCOYLPLU-UHFFFAOYSA-N
MW138.19 g/mol
LogP-0.99
Rot. Bonds3

About 1-amino-2-[methyl(sulfino)amino]ethane

1-amino-2-[methyl(sulfino)amino]ethane (PubChem CID 57089331) has the molecular formula C3H10N2O2S and a molecular weight of 138.19 g/mol. Its IUPAC name is 1-amino-2-[methyl(sulfino)amino]ethane.

Molecular Properties

Compound Name1-amino-2-[methyl(sulfino)amino]ethane
PubChem CID57089331
Molecular FormulaC3H10N2O2S
Molecular Weight138.19 g/mol
Exact Mass138.05
IUPAC Name1-amino-2-[methyl(sulfino)amino]ethane
SMILESCN(CCN)S(=O)O
InChIInChI=1S/C3H10N2O2S/c1-5(3-2-4)8(6)7/h2-4H2,1H3,(H,6,7)
InChIKeyGYBZEGRCOYLPLU-UHFFFAOYSA-N
XLogP-0.99
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.19
LogP ≤ 5-0.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

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Related Compounds

1-(Dimethylamino)-2-(sulfinatoamino)ethane
CID 57157022
2-Aminoethyl(ethyl)sulfamic acid
CID 18358423
1-(Methylamino)-2-[methyl(sulfinato)amino]ethane
CID 56974250
1-Amino-2-[methyl(sulfinato)amino]ethane
CID 57089330
1-(Methylamino)-2-(sulfinatoamino)ethane
CID 57164317
1-Amino-2-[ethyl(sulfinato)amino]ethane
CID 57281727
2-(Ethylamino)ethylsulfamic acid
CID 58800976
1-(Methylamino)-2-(sulfamoylamino)ethane
CID 59215711
1-Amino-2-[methyl(sulfamoyl)amino]ethane
CID 84649813
2-(Dimethylamino)ethylsulfamic acid
CID 88394407
N'-hydroxysulfanyl-N-methylethane-1,2-diamine
CID 89126614
1,1-Dihydroxy-2-methyl-1,2,5-thiadiazolidine
CID 91096968

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-[methyl(sulfino)amino]ethane?
The IUPAC name of 1-amino-2-[methyl(sulfino)amino]ethane (CID 57089331) is 1-amino-2-[methyl(sulfino)amino]ethane.
What is the SMILES notation for 1-amino-2-[methyl(sulfino)amino]ethane?
The canonical SMILES for 1-amino-2-[methyl(sulfino)amino]ethane is CN(CCN)S(=O)O.
What is the InChIKey of 1-amino-2-[methyl(sulfino)amino]ethane?
The InChIKey is GYBZEGRCOYLPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N2O2S/c1-5(3-2-4)8(6)7/h2-4H2,1H3,(H,6,7).
What are the key properties of 1-amino-2-[methyl(sulfino)amino]ethane?
1-amino-2-[methyl(sulfino)amino]ethane has a molecular weight of 138.19 g/mol, XLogP of -0.99, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-[methyl(sulfino)amino]ethane is sourced from PubChem (CID 57089331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).