(E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine

C7H10N2S — CID 18684923

IUPAC(E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine
SMILESC/C=N/c1sc(C)nc1C
InChIInChI=1S/C7H10N2S/c1-4-8-7-5(2)9-6(3)10-7/h4H,1-3H3/b8-4+
InChIKeyUVOPERGURRNWMP-XBXARRHUSA-N
MW154.24 g/mol
LogP2.48
Rot. Bonds1

About (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine

(E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine (PubChem CID 18684923) has the molecular formula C7H10N2S and a molecular weight of 154.24 g/mol. Its IUPAC name is (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine.

Molecular Properties

Compound Name(E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine
PubChem CID18684923
Molecular FormulaC7H10N2S
Molecular Weight154.24 g/mol
Exact Mass154.06
IUPAC Name(E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine
SMILESC/C=N/c1sc(C)nc1C
InChIInChI=1S/C7H10N2S/c1-4-8-7-5(2)9-6(3)10-7/h4H,1-3H3/b8-4+
InChIKeyUVOPERGURRNWMP-XBXARRHUSA-N
XLogP2.48
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.24
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine?
The IUPAC name of (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine (CID 18684923) is (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine.
What is the SMILES notation for (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine?
The canonical SMILES for (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine is C/C=N/c1sc(C)nc1C.
What is the InChIKey of (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine?
The InChIKey is UVOPERGURRNWMP-XBXARRHUSA-N. The full InChI is InChI=1S/C7H10N2S/c1-4-8-7-5(2)9-6(3)10-7/h4H,1-3H3/b8-4+.
What are the key properties of (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine?
(E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine has a molecular weight of 154.24 g/mol, XLogP of 2.48, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2,4-dimethyl-1,3-thiazol-5-yl)ethanimine is sourced from PubChem (CID 18684923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).