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

C6H10N2OS — CID 66860917

IUPAC3-(2-methoxyethyl)-1,3-thiazol-2-imine
SMILES[H]/N=c1\sccn1CCOC
InChIInChI=1S/C6H10N2OS/c1-9-4-2-8-3-5-10-6(8)7/h3,5,7H,2,4H2,1H3/b7-6-
InChIKeyQBTAKUOTIVNKGV-SREVYHEPSA-N
MW158.23 g/mol
LogP0.68
Rot. Bonds3

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

3-(2-methoxyethyl)-1,3-thiazol-2-imine (PubChem CID 66860917) has the molecular formula C6H10N2OS and a molecular weight of 158.23 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-1,3-thiazol-2-imine.

Molecular Properties

Compound Name3-(2-methoxyethyl)-1,3-thiazol-2-imine
PubChem CID66860917
Molecular FormulaC6H10N2OS
Molecular Weight158.23 g/mol
Exact Mass158.05
IUPAC Name3-(2-methoxyethyl)-1,3-thiazol-2-imine
SMILES[H]/N=c1\sccn1CCOC
InChIInChI=1S/C6H10N2OS/c1-9-4-2-8-3-5-10-6(8)7/h3,5,7H,2,4H2,1H3/b7-6-
InChIKeyQBTAKUOTIVNKGV-SREVYHEPSA-N
XLogP0.68
TPSA38.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.23
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-1,3-thiazol-2-imine?
The IUPAC name of 3-(2-methoxyethyl)-1,3-thiazol-2-imine (CID 66860917) is 3-(2-methoxyethyl)-1,3-thiazol-2-imine.
What is the SMILES notation for 3-(2-methoxyethyl)-1,3-thiazol-2-imine?
The canonical SMILES for 3-(2-methoxyethyl)-1,3-thiazol-2-imine is [H]/N=c1\sccn1CCOC.
What is the InChIKey of 3-(2-methoxyethyl)-1,3-thiazol-2-imine?
The InChIKey is QBTAKUOTIVNKGV-SREVYHEPSA-N. The full InChI is InChI=1S/C6H10N2OS/c1-9-4-2-8-3-5-10-6(8)7/h3,5,7H,2,4H2,1H3/b7-6-.
What are the key properties of 3-(2-methoxyethyl)-1,3-thiazol-2-imine?
3-(2-methoxyethyl)-1,3-thiazol-2-imine has a molecular weight of 158.23 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-1,3-thiazol-2-imine is sourced from PubChem (CID 66860917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).