1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine

C8H14N2OS — CID 71755475

IUPAC1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine
SMILESCNCc1csc(C(C)OC)n1
InChIInChI=1S/C8H14N2OS/c1-6(11-3)8-10-7(4-9-2)5-12-8/h5-6,9H,4H2,1-3H3
InChIKeyGBSCXERTQSCIIL-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.57
Rot. Bonds4

About 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine

1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine (PubChem CID 71755475) has the molecular formula C8H14N2OS and a molecular weight of 186.28 g/mol. Its IUPAC name is 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine
PubChem CID71755475
Molecular FormulaC8H14N2OS
Molecular Weight186.28 g/mol
Exact Mass186.08
IUPAC Name1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine
SMILESCNCc1csc(C(C)OC)n1
InChIInChI=1S/C8H14N2OS/c1-6(11-3)8-10-7(4-9-2)5-12-8/h5-6,9H,4H2,1-3H3
InChIKeyGBSCXERTQSCIIL-UHFFFAOYSA-N
XLogP1.57
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine (CID 71755475) is 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine is CNCc1csc(C(C)OC)n1.
What is the InChIKey of 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine?
The InChIKey is GBSCXERTQSCIIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2OS/c1-6(11-3)8-10-7(4-9-2)5-12-8/h5-6,9H,4H2,1-3H3.
What are the key properties of 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine?
1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine has a molecular weight of 186.28 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-methoxyethyl)-1,3-thiazol-4-yl]-N-methylmethanamine is sourced from PubChem (CID 71755475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).