2,3-diethyl-2H-1,3-thiazole

C7H13NS — CID 146223311

IUPAC2,3-diethyl-2H-1,3-thiazole
SMILESCCC1SC=CN1CC
InChIInChI=1S/C7H13NS/c1-3-7-8(4-2)5-6-9-7/h5-7H,3-4H2,1-2H3
InChIKeyCXFJVGHATGUFCT-UHFFFAOYSA-N
MW143.25 g/mol
LogP2.26
Rot. Bonds2

About 2,3-diethyl-2H-1,3-thiazole

2,3-diethyl-2H-1,3-thiazole (PubChem CID 146223311) has the molecular formula C7H13NS and a molecular weight of 143.25 g/mol. Its IUPAC name is 2,3-diethyl-2H-1,3-thiazole.

Molecular Properties

Compound Name2,3-diethyl-2H-1,3-thiazole
PubChem CID146223311
Molecular FormulaC7H13NS
Molecular Weight143.25 g/mol
Exact Mass143.08
IUPAC Name2,3-diethyl-2H-1,3-thiazole
SMILESCCC1SC=CN1CC
InChIInChI=1S/C7H13NS/c1-3-7-8(4-2)5-6-9-7/h5-7H,3-4H2,1-2H3
InChIKeyCXFJVGHATGUFCT-UHFFFAOYSA-N
XLogP2.26
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.25
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,3-diethyl-2H-1,3-thiazole with MolForge

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

Launch Full Analysis

Related Compounds

2-ethyl-3-(trifluoromethyl)-2H-1,3-thiazole
CID 173055833
3-(difluoromethyl)-2-ethyl-2H-1,3-thiazole
CID 173055860
3-ethyl-2H-1,3-thiazole
CID 18381193
3-ethyl-2-methyl-2H-1,3-thiazole
CID 19366383
2-methyl-3-propyl-2H-1,3-thiazole
CID 22419292
2,3-dimethyl-2H-1,3-thiazole
CID 23182463
3-Ethyl-2-methylidene-1,3-thiazole
CID 53650336
3-propyl-2H-1,3-thiazole
CID 54072042
3-butyl-2H-1,3-thiazole
CID 57017681
2-Methylidene-3-propyl-1,3-thiazole
CID 59168910
(2S)-2,3-dimethyl-2H-1,3-thiazole
CID 59864797
N-ethenyl-3-methylsulfanyl-N-propylpropan-1-amine
CID 89719133

Frequently Asked Questions

What is the IUPAC name of 2,3-diethyl-2H-1,3-thiazole?
The IUPAC name of 2,3-diethyl-2H-1,3-thiazole (CID 146223311) is 2,3-diethyl-2H-1,3-thiazole.
What is the SMILES notation for 2,3-diethyl-2H-1,3-thiazole?
The canonical SMILES for 2,3-diethyl-2H-1,3-thiazole is CCC1SC=CN1CC.
What is the InChIKey of 2,3-diethyl-2H-1,3-thiazole?
The InChIKey is CXFJVGHATGUFCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NS/c1-3-7-8(4-2)5-6-9-7/h5-7H,3-4H2,1-2H3.
What are the key properties of 2,3-diethyl-2H-1,3-thiazole?
2,3-diethyl-2H-1,3-thiazole has a molecular weight of 143.25 g/mol, XLogP of 2.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethyl-2H-1,3-thiazole is sourced from PubChem (CID 146223311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).