2,5-diethyl-2,5-dihydro-1,3-thiazole

C7H13NS — CID 3065522

IUPAC2,5-diethyl-2,5-dihydro-1,3-thiazole
SMILESCCC1C=NC(CC)S1
InChIInChI=1S/C7H13NS/c1-3-6-5-8-7(4-2)9-6/h5-7H,3-4H2,1-2H3
InChIKeyRSABWSHGINRJDU-UHFFFAOYSA-N
MW143.25 g/mol
LogP2.32
Rot. Bonds2

About 2,5-diethyl-2,5-dihydro-1,3-thiazole

2,5-diethyl-2,5-dihydro-1,3-thiazole (PubChem CID 3065522) has the molecular formula C7H13NS and a molecular weight of 143.25 g/mol. Its IUPAC name is 2,5-diethyl-2,5-dihydro-1,3-thiazole.

Molecular Properties

Compound Name2,5-diethyl-2,5-dihydro-1,3-thiazole
PubChem CID3065522
Molecular FormulaC7H13NS
Molecular Weight143.25 g/mol
Exact Mass143.08
IUPAC Name2,5-diethyl-2,5-dihydro-1,3-thiazole
SMILESCCC1C=NC(CC)S1
InChIInChI=1S/C7H13NS/c1-3-6-5-8-7(4-2)9-6/h5-7H,3-4H2,1-2H3
InChIKeyRSABWSHGINRJDU-UHFFFAOYSA-N
XLogP2.32
TPSA12.36 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 ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,5-diethyl-2,5-dihydro-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-4,5-dimethyl-3-thiazoline
CID 5362584
2,4-Dimethyl-3-thiazoline
CID 108501
2-Isobutyl-3-thiazoline
CID 14701079
2,4,5-Trimethyl-2,5-dihydro-1,3-thiazole
CID 181287
2-Ethyl-4,5-dihydrothiazole
CID 86896
Thiazole, 4,5-dihydro-2-butyl-
CID 206597
2-Ethyl-4-methyl-3-thiazoline
CID 58165301
2-Ethyl-4,5-dihydro-5-methylthiazole
CID 205800
Thiazole, 4,5-dihydro-2-propyl-
CID 211465
3-Thiazoline, 2-methyl-
CID 3050621
2-Ethyl-5-methyl-3-thiazoline
CID 13738286
3-Thiazoline, 2,2-dimethyl-
CID 3050569

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-2,5-dihydro-1,3-thiazole?
The IUPAC name of 2,5-diethyl-2,5-dihydro-1,3-thiazole (CID 3065522) is 2,5-diethyl-2,5-dihydro-1,3-thiazole.
What is the SMILES notation for 2,5-diethyl-2,5-dihydro-1,3-thiazole?
The canonical SMILES for 2,5-diethyl-2,5-dihydro-1,3-thiazole is CCC1C=NC(CC)S1.
What is the InChIKey of 2,5-diethyl-2,5-dihydro-1,3-thiazole?
The InChIKey is RSABWSHGINRJDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NS/c1-3-6-5-8-7(4-2)9-6/h5-7H,3-4H2,1-2H3.
What are the key properties of 2,5-diethyl-2,5-dihydro-1,3-thiazole?
2,5-diethyl-2,5-dihydro-1,3-thiazole has a molecular weight of 143.25 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-2,5-dihydro-1,3-thiazole is sourced from PubChem (CID 3065522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).