[methyl(sulfinato)amino]cyclopropane

C4H8NO2S- — CID 66619000

IUPAC[methyl(sulfinato)amino]cyclopropane
SMILESCN(C1CC1)S(=O)[O-]
InChIInChI=1S/C4H9NO2S/c1-5(8(6)7)4-2-3-4/h4H,2-3H2,1H3,(H,6,7)/p-1
InChIKeyQJHIHZITSBTHMH-UHFFFAOYSA-M
MW134.18 g/mol
LogP-0.13
Rot. Bonds2

About [methyl(sulfinato)amino]cyclopropane

[methyl(sulfinato)amino]cyclopropane (PubChem CID 66619000) has the molecular formula C4H8NO2S- and a molecular weight of 134.18 g/mol. Its IUPAC name is [methyl(sulfinato)amino]cyclopropane.

Molecular Properties

Compound Name[methyl(sulfinato)amino]cyclopropane
PubChem CID66619000
Molecular FormulaC4H8NO2S-
Molecular Weight134.18 g/mol
Exact Mass134.03
IUPAC Name[methyl(sulfinato)amino]cyclopropane
SMILESCN(C1CC1)S(=O)[O-]
InChIInChI=1S/C4H9NO2S/c1-5(8(6)7)4-2-3-4/h4H,2-3H2,1H3,(H,6,7)/p-1
InChIKeyQJHIHZITSBTHMH-UHFFFAOYSA-M
XLogP-0.13
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 5-0.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [methyl(sulfinato)amino]cyclopropane?
The IUPAC name of [methyl(sulfinato)amino]cyclopropane (CID 66619000) is [methyl(sulfinato)amino]cyclopropane.
What is the SMILES notation for [methyl(sulfinato)amino]cyclopropane?
The canonical SMILES for [methyl(sulfinato)amino]cyclopropane is CN(C1CC1)S(=O)[O-].
What is the InChIKey of [methyl(sulfinato)amino]cyclopropane?
The InChIKey is QJHIHZITSBTHMH-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H9NO2S/c1-5(8(6)7)4-2-3-4/h4H,2-3H2,1H3,(H,6,7)/p-1.
What are the key properties of [methyl(sulfinato)amino]cyclopropane?
[methyl(sulfinato)amino]cyclopropane has a molecular weight of 134.18 g/mol, XLogP of -0.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl(sulfinato)amino]cyclopropane is sourced from PubChem (CID 66619000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).