5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole

C9H11N3S — CID 10583936

IUPAC5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole
SMILESCCc1cnc(Cc2cnc[nH]2)s1
InChIInChI=1S/C9H11N3S/c1-2-8-5-11-9(13-8)3-7-4-10-6-12-7/h4-6H,2-3H2,1H3,(H,10,12)
InChIKeyPZTINWSYVWYRIL-UHFFFAOYSA-N
MW193.28 g/mol
LogP2.02
Rot. Bonds3

About 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole

5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole (PubChem CID 10583936) has the molecular formula C9H11N3S and a molecular weight of 193.28 g/mol. Its IUPAC name is 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole.

Molecular Properties

Compound Name5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole
PubChem CID10583936
Molecular FormulaC9H11N3S
Molecular Weight193.28 g/mol
Exact Mass193.07
IUPAC Name5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole
SMILESCCc1cnc(Cc2cnc[nH]2)s1
InChIInChI=1S/C9H11N3S/c1-2-8-5-11-9(13-8)3-7-4-10-6-12-7/h4-6H,2-3H2,1H3,(H,10,12)
InChIKeyPZTINWSYVWYRIL-UHFFFAOYSA-N
XLogP2.02
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.28
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-ethyl-2-(1H-imidazol-5-ylmethyl)-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-(1H-imidazol-5-ylmethyl)-4,5,6,7-tetrahydro-1,3-benzothiazole
CID 9813232
[2-(1H-Imidazol-4-yl)-ethyl]-thiazol-2-yl-amine
CID 10081340
1H-2-imidazolyl 2-(1H-4-imidazolyl)ethyl sulfide
CID 15212461
2-(1H-imidazol-5-ylmethyl)-4,5-dimethyl-1,3-thiazole
CID 9990190
5-ethyl-4-(1H-imidazol-5-ylmethyl)-2-methyl-1,3-thiazole
CID 10013259
2,5-diethyl-4-(1H-imidazol-5-ylmethyl)-1,3-thiazole
CID 10331102
5-(1H-imidazol-5-ylmethyl)-2,4-dimethyl-1,3-thiazole
CID 10465209
4-(1H-imidazol-5-ylmethyl)-2,5-dimethyl-1,3-thiazole
CID 10559697
5-((1H-Imidazol-4-yl)methyl)-2,4-diethylthiazole
CID 10560957
5-[1-(1H-imidazol-5-yl)ethyl]-2,4-dimethyl-1,3-thiazole
CID 10584459
4-ethyl-2-(1H-imidazol-5-ylmethyl)-5-methyl-1,3-thiazole
CID 10584460
4,5-diethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole
CID 10609025

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole?
The IUPAC name of 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole (CID 10583936) is 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole.
What is the SMILES notation for 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole?
The canonical SMILES for 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole is CCc1cnc(Cc2cnc[nH]2)s1.
What is the InChIKey of 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole?
The InChIKey is PZTINWSYVWYRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3S/c1-2-8-5-11-9(13-8)3-7-4-10-6-12-7/h4-6H,2-3H2,1H3,(H,10,12).
What are the key properties of 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole?
5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole has a molecular weight of 193.28 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(1H-imidazol-5-ylmethyl)-1,3-thiazole is sourced from PubChem (CID 10583936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).