N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine

C8H12N2S — CID 154410935

IUPACN-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine
SMILESC=CNC=CSC=CNC=C
InChIInChI=1S/C8H12N2S/c1-3-9-5-7-11-8-6-10-4-2/h3-10H,1-2H2
InChIKeyXPKNHMIMRAOFCQ-UHFFFAOYSA-N
MW168.26 g/mol
LogP2.13
Rot. Bonds6

About N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine

N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine (PubChem CID 154410935) has the molecular formula C8H12N2S and a molecular weight of 168.26 g/mol. Its IUPAC name is N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine.

Molecular Properties

Compound NameN-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine
PubChem CID154410935
Molecular FormulaC8H12N2S
Molecular Weight168.26 g/mol
Exact Mass168.07
IUPAC NameN-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine
SMILESC=CNC=CSC=CNC=C
InChIInChI=1S/C8H12N2S/c1-3-9-5-7-11-8-6-10-4-2/h3-10H,1-2H2
InChIKeyXPKNHMIMRAOFCQ-UHFFFAOYSA-N
XLogP2.13
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(Z)-N-ethenyl-N',N'-dimethylethene-1,2-diamine
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(E)-3-(ethenylamino)prop-2-enal
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(Z)-2-ethenylsulfanyl-N-iodoethenamine
CID 89126075
3-(ethenylamino)prop-2-enoic acid
CID 87774875
N-ethenylformamide;polane
CID 173327800
N-methylsulfanylethenamine
CID 166090975
N-silylethenamine
CID 149435694
(E)-1-N-ethenylprop-1-ene-1,2-diamine
CID 142054604
ethenylsulfanylethene;hydrate
CID 137369807
ethenoxysilane
CID 71403767
(1Z,3E)-1-[(1E)-buta-1,3-dienyl]sulfanylpenta-1,3-diene
CID 89037486
ethane;N-ethenyl-N'-ethylmethanimidamide
CID 143333894

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine?
The IUPAC name of N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine (CID 154410935) is N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine.
What is the SMILES notation for N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine?
The canonical SMILES for N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine is C=CNC=CSC=CNC=C.
What is the InChIKey of N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine?
The InChIKey is XPKNHMIMRAOFCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2S/c1-3-9-5-7-11-8-6-10-4-2/h3-10H,1-2H2.
What are the key properties of N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine?
N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine has a molecular weight of 168.26 g/mol, XLogP of 2.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2-[2-(ethenylamino)ethenylsulfanyl]ethenamine is sourced from PubChem (CID 154410935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).