ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine

C7H12N2S — CID 166455841

IUPACethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine
SMILESCC.N/C=C\c1nccs1
InChIInChI=1S/C5H6N2S.C2H6/c6-2-1-5-7-3-4-8-5;1-2/h1-4H,6H2;1-2H3/b2-1-;
InChIKeyKHFGIQAPGSWNNZ-ODZAUARKSA-N
MW156.25 g/mol
LogP2.10
Rot. Bonds1

About ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine

ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine (PubChem CID 166455841) has the molecular formula C7H12N2S and a molecular weight of 156.25 g/mol. Its IUPAC name is ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine.

Molecular Properties

Compound Nameethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine
PubChem CID166455841
Molecular FormulaC7H12N2S
Molecular Weight156.25 g/mol
Exact Mass156.07
IUPAC Nameethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine
SMILESCC.N/C=C\c1nccs1
InChIInChI=1S/C5H6N2S.C2H6/c6-2-1-5-7-3-4-8-5;1-2/h1-4H,6H2;1-2H3/b2-1-;
InChIKeyKHFGIQAPGSWNNZ-ODZAUARKSA-N
XLogP2.10
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine?
The IUPAC name of ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine (CID 166455841) is ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine.
What is the SMILES notation for ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine?
The canonical SMILES for ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine is CC.N/C=C\c1nccs1.
What is the InChIKey of ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine?
The InChIKey is KHFGIQAPGSWNNZ-ODZAUARKSA-N. The full InChI is InChI=1S/C5H6N2S.C2H6/c6-2-1-5-7-3-4-8-5;1-2/h1-4H,6H2;1-2H3/b2-1-;.
What are the key properties of ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine?
ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine has a molecular weight of 156.25 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine is sourced from PubChem (CID 166455841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).