1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol

C8H14N2OS — CID 64544599

IUPAC1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol
SMILESCCN(C)c1nc(C(C)O)cs1
InChIInChI=1S/C8H14N2OS/c1-4-10(3)8-9-7(5-12-8)6(2)11/h5-6,11H,4H2,1-3H3
InChIKeyDKZBSRCMGAUSLR-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.65
Rot. Bonds3

About 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol

1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol (PubChem CID 64544599) has the molecular formula C8H14N2OS and a molecular weight of 186.28 g/mol. Its IUPAC name is 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol.

Molecular Properties

Compound Name1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol
PubChem CID64544599
Molecular FormulaC8H14N2OS
Molecular Weight186.28 g/mol
Exact Mass186.08
IUPAC Name1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol
SMILESCCN(C)c1nc(C(C)O)cs1
InChIInChI=1S/C8H14N2OS/c1-4-10(3)8-9-7(5-12-8)6(2)11/h5-6,11H,4H2,1-3H3
InChIKeyDKZBSRCMGAUSLR-UHFFFAOYSA-N
XLogP1.65
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol?
The IUPAC name of 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol (CID 64544599) is 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol.
What is the SMILES notation for 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol?
The canonical SMILES for 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol is CCN(C)c1nc(C(C)O)cs1.
What is the InChIKey of 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol?
The InChIKey is DKZBSRCMGAUSLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2OS/c1-4-10(3)8-9-7(5-12-8)6(2)11/h5-6,11H,4H2,1-3H3.
What are the key properties of 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol?
1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol has a molecular weight of 186.28 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[ethyl(methyl)amino]-1,3-thiazol-4-yl]ethanol is sourced from PubChem (CID 64544599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).