4-ethyl-2-(1-methoxyethyl)-1,3-thiazole

C8H13NOS — CID 115680000

IUPAC4-ethyl-2-(1-methoxyethyl)-1,3-thiazole
SMILESCCc1csc(C(C)OC)n1
InChIInChI=1S/C8H13NOS/c1-4-7-5-11-8(9-7)6(2)10-3/h5-6H,4H2,1-3H3
InChIKeyOJVFNZHHVVPWIB-UHFFFAOYSA-N
MW171.26 g/mol
LogP2.41
Rot. Bonds3

About 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole

4-ethyl-2-(1-methoxyethyl)-1,3-thiazole (PubChem CID 115680000) has the molecular formula C8H13NOS and a molecular weight of 171.26 g/mol. Its IUPAC name is 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole.

Molecular Properties

Compound Name4-ethyl-2-(1-methoxyethyl)-1,3-thiazole
PubChem CID115680000
Molecular FormulaC8H13NOS
Molecular Weight171.26 g/mol
Exact Mass171.07
IUPAC Name4-ethyl-2-(1-methoxyethyl)-1,3-thiazole
SMILESCCc1csc(C(C)OC)n1
InChIInChI=1S/C8H13NOS/c1-4-7-5-11-8(9-7)6(2)10-3/h5-6H,4H2,1-3H3
InChIKeyOJVFNZHHVVPWIB-UHFFFAOYSA-N
XLogP2.41
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(4-ethyl-1,3-thiazol-2-yl)ethanamine
CID 42077975
N-[[2-(1-methoxyethyl)-1,3-thiazol-4-yl]methyl]-N-methylpropane-1-sulfonamide
CID 71981126
2-[(1S)-1-methoxyethyl]-4-(triazol-1-ylmethyl)-1,3-thiazole
CID 99621422
2-[(1S)-1-methoxyethyl]-4-(piperazin-1-ylmethyl)-1,3-thiazole
CID 95789668
1-[[2-[(1S)-1-methoxyethyl]-1,3-thiazol-4-yl]methyl]-1,3,3-trimethylurea
CID 99775487
(2S)-2-[benzyl-[[2-(1-methoxyethyl)-1,3-thiazol-4-yl]methyl]amino]butan-1-ol
CID 75455984
4-[[(3aS,7aS)-1,3,3a,4,7,7a-hexahydroisoindol-2-yl]methyl]-2-[(1R)-1-methoxyethyl]-1,3-thiazole
CID 97220170
methyl 2-[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]acetate
CID 78992497
5-chloro-N-[[2-(1-methoxyethyl)-1,3-thiazol-4-yl]methyl]-N-methylpyrimidin-2-amine
CID 133337743
3-amino-N-[[2-(1-methoxyethyl)-1,3-thiazol-4-yl]methyl]butanamide;dihydrochloride
CID 119900150
5-[[2-[(1R)-1-methoxyethyl]-1,3-thiazol-4-yl]methylsulfanyl]-N-methyl-1,3,4-thiadiazol-2-amine
CID 124609482
N-[[2-(1-methoxyethyl)-1,3-thiazol-4-yl]methyl]-4-(methylamino)butanamide
CID 119900109

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole?
The IUPAC name of 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole (CID 115680000) is 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole.
What is the SMILES notation for 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole?
The canonical SMILES for 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole is CCc1csc(C(C)OC)n1.
What is the InChIKey of 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole?
The InChIKey is OJVFNZHHVVPWIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NOS/c1-4-7-5-11-8(9-7)6(2)10-3/h5-6H,4H2,1-3H3.
What are the key properties of 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole?
4-ethyl-2-(1-methoxyethyl)-1,3-thiazole has a molecular weight of 171.26 g/mol, XLogP of 2.41, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(1-methoxyethyl)-1,3-thiazole is sourced from PubChem (CID 115680000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).