4-ethyl-2-methyl-1,3-thiazole;hydrochloride

C6H10ClNS — CID 141419064

IUPAC4-ethyl-2-methyl-1,3-thiazole;hydrochloride
SMILESCCc1csc(C)n1.Cl
InChIInChI=1S/C6H9NS.ClH/c1-3-6-4-8-5(2)7-6;/h4H,3H2,1-2H3;1H
InChIKeyVQPZOBPZTGMKHC-UHFFFAOYSA-N
MW163.67 g/mol
LogP2.44
Rot. Bonds1

About 4-ethyl-2-methyl-1,3-thiazole;hydrochloride

4-ethyl-2-methyl-1,3-thiazole;hydrochloride (PubChem CID 141419064) has the molecular formula C6H10ClNS and a molecular weight of 163.67 g/mol. Its IUPAC name is 4-ethyl-2-methyl-1,3-thiazole;hydrochloride.

Molecular Properties

Compound Name4-ethyl-2-methyl-1,3-thiazole;hydrochloride
PubChem CID141419064
Molecular FormulaC6H10ClNS
Molecular Weight163.67 g/mol
Exact Mass163.02
IUPAC Name4-ethyl-2-methyl-1,3-thiazole;hydrochloride
SMILESCCc1csc(C)n1.Cl
InChIInChI=1S/C6H9NS.ClH/c1-3-6-4-8-5(2)7-6;/h4H,3H2,1-2H3;1H
InChIKeyVQPZOBPZTGMKHC-UHFFFAOYSA-N
XLogP2.44
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.67
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(chloromethyl)-2-methyl-1,3-thiazole;dihydrochloride
CID 133061330
N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine;hydrate;dihydrochloride
CID 74892089
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine
CID 86812794
1-(2-methyl-1,3-thiazol-4-yl)butan-2-one
CID 62799842
(2S)-1-(2-methyl-1,3-thiazol-4-yl)butan-2-amine
CID 94607240
1-(2-methyl-1,3-thiazol-4-yl)butan-2-amine
CID 62798804
1-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]hydrazine
CID 89029484
4-[(Z)-but-2-enyl]-2-methyl-1,3-thiazole
CID 143071473
2-methyl-4-(2-methyl-1,3-thiazol-4-yl)butan-2-amine
CID 116888513
N-ethyl-3-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine
CID 65268800
N-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine
CID 86855936
[1,1,1-trifluoro-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine
CID 105215784

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-methyl-1,3-thiazole;hydrochloride?
The IUPAC name of 4-ethyl-2-methyl-1,3-thiazole;hydrochloride (CID 141419064) is 4-ethyl-2-methyl-1,3-thiazole;hydrochloride.
What is the SMILES notation for 4-ethyl-2-methyl-1,3-thiazole;hydrochloride?
The canonical SMILES for 4-ethyl-2-methyl-1,3-thiazole;hydrochloride is CCc1csc(C)n1.Cl.
What is the InChIKey of 4-ethyl-2-methyl-1,3-thiazole;hydrochloride?
The InChIKey is VQPZOBPZTGMKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NS.ClH/c1-3-6-4-8-5(2)7-6;/h4H,3H2,1-2H3;1H.
What are the key properties of 4-ethyl-2-methyl-1,3-thiazole;hydrochloride?
4-ethyl-2-methyl-1,3-thiazole;hydrochloride has a molecular weight of 163.67 g/mol, XLogP of 2.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-methyl-1,3-thiazole;hydrochloride is sourced from PubChem (CID 141419064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).