1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine

C11H15ClN4S — CID 114239483

IUPAC1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine
SMILESCCNC(C)c1csc(-c2ncc(Cl)n2C)n1
InChIInChI=1S/C11H15ClN4S/c1-4-13-7(2)8-6-17-11(15-8)10-14-5-9(12)16(10)3/h5-7,13H,4H2,1-3H3
InChIKeySVHJUGHFXUKOMK-UHFFFAOYSA-N
MW270.79 g/mol
LogP2.87
Rot. Bonds4

About 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine

1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine (PubChem CID 114239483) has the molecular formula C11H15ClN4S and a molecular weight of 270.79 g/mol. Its IUPAC name is 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine.

Molecular Properties

Compound Name1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine
PubChem CID114239483
Molecular FormulaC11H15ClN4S
Molecular Weight270.79 g/mol
Exact Mass270.07
IUPAC Name1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine
SMILESCCNC(C)c1csc(-c2ncc(Cl)n2C)n1
InChIInChI=1S/C11H15ClN4S/c1-4-13-7(2)8-6-17-11(15-8)10-14-5-9(12)16(10)3/h5-7,13H,4H2,1-3H3
InChIKeySVHJUGHFXUKOMK-UHFFFAOYSA-N
XLogP2.87
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.79
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine 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

1-[2-(4-chlorothiophen-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine
CID 79427319
N-ethyl-1-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanamine
CID 64542865
1-[2-(5-chloro-2-fluorophenyl)-1,3-thiazol-4-yl]-N-ethylethanamine
CID 64543276
N-ethyl-1-[2-(2-fluoro-3-methylphenyl)-1,3-thiazol-4-yl]ethanamine
CID 107111648
N,N-diethyl-4-[1-(ethylamino)ethyl]-1,3-thiazol-2-amine
CID 64542709
1-[2-(2-bromophenyl)-1,3-thiazol-4-yl]-N-ethylethanamine
CID 64544083
N-ethyl-1-[2-(4-fluoro-3-methylphenyl)-1,3-thiazol-4-yl]ethanamine
CID 64544285
4-[1-(ethylamino)ethyl]-N,N-dimethyl-1,3-thiazol-2-amine
CID 64542711
1-[2-(2,5-dimethoxyphenyl)-1,3-thiazol-4-yl]-N-ethylethanamine
CID 64544101
N-ethyl-1-(2-pentan-3-yl-1,3-thiazol-4-yl)ethanamine
CID 64545111
4-[1-(ethylamino)ethyl]-N,N-bis(3-methylbutyl)-1,3-thiazol-2-amine
CID 107871475
N-ethyl-1-[2-(2-methyl-5-nitrophenyl)-1,3-thiazol-4-yl]ethanamine
CID 64545097

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine?
The IUPAC name of 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine (CID 114239483) is 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine.
What is the SMILES notation for 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine?
The canonical SMILES for 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine is CCNC(C)c1csc(-c2ncc(Cl)n2C)n1.
What is the InChIKey of 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine?
The InChIKey is SVHJUGHFXUKOMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN4S/c1-4-13-7(2)8-6-17-11(15-8)10-14-5-9(12)16(10)3/h5-7,13H,4H2,1-3H3.
What are the key properties of 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine?
1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine has a molecular weight of 270.79 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-chloro-1-methylimidazol-2-yl)-1,3-thiazol-4-yl]-N-ethylethanamine is sourced from PubChem (CID 114239483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).