4-ethenyl-1,3-thiazol-2-amine

C5H6N2S — CID 54226504

IUPAC4-ethenyl-1,3-thiazol-2-amine
SMILESC=Cc1csc(N)n1
InChIInChI=1S/C5H6N2S/c1-2-4-3-8-5(6)7-4/h2-3H,1H2,(H2,6,7)
InChIKeyBAPHBBOWQSQDCE-UHFFFAOYSA-N
MW126.18 g/mol
LogP1.37
Rot. Bonds1

About 4-ethenyl-1,3-thiazol-2-amine

4-ethenyl-1,3-thiazol-2-amine (PubChem CID 54226504) has the molecular formula C5H6N2S and a molecular weight of 126.18 g/mol. Its IUPAC name is 4-ethenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-ethenyl-1,3-thiazol-2-amine
PubChem CID54226504
Molecular FormulaC5H6N2S
Molecular Weight126.18 g/mol
Exact Mass126.03
IUPAC Name4-ethenyl-1,3-thiazol-2-amine
SMILESC=Cc1csc(N)n1
InChIInChI=1S/C5H6N2S/c1-2-4-3-8-5(6)7-4/h2-3H,1H2,(H2,6,7)
InChIKeyBAPHBBOWQSQDCE-UHFFFAOYSA-N
XLogP1.37
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.18
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1,3-thiazol-2-amine?
The IUPAC name of 4-ethenyl-1,3-thiazol-2-amine (CID 54226504) is 4-ethenyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-ethenyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-ethenyl-1,3-thiazol-2-amine is C=Cc1csc(N)n1.
What is the InChIKey of 4-ethenyl-1,3-thiazol-2-amine?
The InChIKey is BAPHBBOWQSQDCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2S/c1-2-4-3-8-5(6)7-4/h2-3H,1H2,(H2,6,7).
What are the key properties of 4-ethenyl-1,3-thiazol-2-amine?
4-ethenyl-1,3-thiazol-2-amine has a molecular weight of 126.18 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 54226504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).