N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide

C6H12N2OS — CID 154967162

IUPACN'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide
SMILESC=C/N=C(\N(C)C)S(C)=O
InChIInChI=1S/C6H12N2OS/c1-5-7-6(8(2)3)10(4)9/h5H,1H2,2-4H3/b7-6+
InChIKeyHTNGDNZEGJSXRQ-VOTSOKGWSA-N
MW160.24 g/mol
LogP0.43
Rot. Bonds1

About N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide

N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide (PubChem CID 154967162) has the molecular formula C6H12N2OS and a molecular weight of 160.24 g/mol. Its IUPAC name is N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide.

Molecular Properties

Compound NameN'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide
PubChem CID154967162
Molecular FormulaC6H12N2OS
Molecular Weight160.24 g/mol
Exact Mass160.07
IUPAC NameN'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide
SMILESC=C/N=C(\N(C)C)S(C)=O
InChIInChI=1S/C6H12N2OS/c1-5-7-6(8(2)3)10(4)9/h5H,1H2,2-4H3/b7-6+
InChIKeyHTNGDNZEGJSXRQ-VOTSOKGWSA-N
XLogP0.43
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.24
LogP ≤ 50.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide?
The IUPAC name of N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide (CID 154967162) is N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide.
What is the SMILES notation for N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide?
The canonical SMILES for N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide is C=C/N=C(\N(C)C)S(C)=O.
What is the InChIKey of N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide?
The InChIKey is HTNGDNZEGJSXRQ-VOTSOKGWSA-N. The full InChI is InChI=1S/C6H12N2OS/c1-5-7-6(8(2)3)10(4)9/h5H,1H2,2-4H3/b7-6+.
What are the key properties of N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide?
N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide has a molecular weight of 160.24 g/mol, XLogP of 0.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethenyl-N,N-dimethyl-1-methylsulfinylmethanimidamide is sourced from PubChem (CID 154967162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).