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

C9H11N3S — CID 130847397

IUPAC5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole
SMILESCCc1cnc(Cn2ccnc2)s1
InChIInChI=1S/C9H11N3S/c1-2-8-5-11-9(13-8)6-12-4-3-10-7-12/h3-5,7H,2,6H2,1H3
InChIKeyFPEWKBIHQBFFIW-UHFFFAOYSA-N
MW193.28 g/mol
LogP1.95
Rot. Bonds3

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

5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole (PubChem CID 130847397) has the molecular formula C9H11N3S and a molecular weight of 193.28 g/mol. Its IUPAC name is 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole.

Molecular Properties

Compound Name5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole
PubChem CID130847397
Molecular FormulaC9H11N3S
Molecular Weight193.28 g/mol
Exact Mass193.07
IUPAC Name5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole
SMILESCCc1cnc(Cn2ccnc2)s1
InChIInChI=1S/C9H11N3S/c1-2-8-5-11-9(13-8)6-12-4-3-10-7-12/h3-5,7H,2,6H2,1H3
InChIKeyFPEWKBIHQBFFIW-UHFFFAOYSA-N
XLogP1.95
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.28
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-2-(imidazol-1-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-(imidazol-1-ylmethyl)-1,3-thiazole-5-carboxylic acid
CID 131142423
2-chloro-5-(imidazol-1-ylmethyl)-1,3-thiazole
CID 1488034
1-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-3-(2-imidazol-1-ylethyl)-2-methylguanidine
CID 111531465
5-(imidazol-1-ylmethyl)-3H-1,3,4-thiadiazole-2-thione
CID 118428593
5-ethyl-2-[(3-methylazetidin-1-yl)methyl]-1,3-thiazole
CID 131020524
1-[(5-ethyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-c]pyridin-2-amine
CID 114128300
1-[[3,5-bis(imidazol-1-ylmethyl)-2,4,6-trimethoxyphenyl]methyl]imidazole
CID 102363409
1-[(2,3,4,5,6-pentamethylphenyl)methyl]imidazole
CID 53322953
4-(imidazol-1-ylmethyl)-2,5-dimethyl-1,3-thiazole
CID 22285692
1-ethylimidazole;hydroiodide
CID 66751695
copper;1-ethylimidazole
CID 118057388
2,5-dipropyl-1,3-thiazole
CID 588151

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole?
The IUPAC name of 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole (CID 130847397) is 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole.
What is the SMILES notation for 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole?
The canonical SMILES for 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole is CCc1cnc(Cn2ccnc2)s1.
What is the InChIKey of 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole?
The InChIKey is FPEWKBIHQBFFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3S/c1-2-8-5-11-9(13-8)6-12-4-3-10-7-12/h3-5,7H,2,6H2,1H3.
What are the key properties of 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole?
5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole has a molecular weight of 193.28 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(imidazol-1-ylmethyl)-1,3-thiazole is sourced from PubChem (CID 130847397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).