5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine

C7H12N2O2S — CID 66860651

IUPAC5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine
SMILES[H]/N=c1\sc(OC)cn1CCOC
InChIInChI=1S/C7H12N2O2S/c1-10-4-3-9-5-6(11-2)12-7(9)8/h5,8H,3-4H2,1-2H3/b8-7-
InChIKeyKENQDEVWRNSXFK-FPLPWBNLSA-N
MW188.25 g/mol
LogP0.68
Rot. Bonds4

About 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine

5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine (PubChem CID 66860651) has the molecular formula C7H12N2O2S and a molecular weight of 188.25 g/mol. Its IUPAC name is 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine.

Molecular Properties

Compound Name5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine
PubChem CID66860651
Molecular FormulaC7H12N2O2S
Molecular Weight188.25 g/mol
Exact Mass188.06
IUPAC Name5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine
SMILES[H]/N=c1\sc(OC)cn1CCOC
InChIInChI=1S/C7H12N2O2S/c1-10-4-3-9-5-6(11-2)12-7(9)8/h5,8H,3-4H2,1-2H3/b8-7-
InChIKeyKENQDEVWRNSXFK-FPLPWBNLSA-N
XLogP0.68
TPSA47.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.25
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine?
The IUPAC name of 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine (CID 66860651) is 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine.
What is the SMILES notation for 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine?
The canonical SMILES for 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine is [H]/N=c1\sc(OC)cn1CCOC.
What is the InChIKey of 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine?
The InChIKey is KENQDEVWRNSXFK-FPLPWBNLSA-N. The full InChI is InChI=1S/C7H12N2O2S/c1-10-4-3-9-5-6(11-2)12-7(9)8/h5,8H,3-4H2,1-2H3/b8-7-.
What are the key properties of 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine?
5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine has a molecular weight of 188.25 g/mol, XLogP of 0.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-(2-methoxyethyl)-1,3-thiazol-2-imine is sourced from PubChem (CID 66860651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).