2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine

C11H16N4S — CID 105165882

IUPAC2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
SMILESCCn1ccnc1CC(N)c1csc(C)n1
InChIInChI=1S/C11H16N4S/c1-3-15-5-4-13-11(15)6-9(12)10-7-16-8(2)14-10/h4-5,7,9H,3,6,12H2,1-2H3
InChIKeyNHRPOPFQXRDHJP-UHFFFAOYSA-N
MW236.34 g/mol
LogP1.91
Rot. Bonds4

About 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine

2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine (PubChem CID 105165882) has the molecular formula C11H16N4S and a molecular weight of 236.34 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
PubChem CID105165882
Molecular FormulaC11H16N4S
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
SMILESCCn1ccnc1CC(N)c1csc(C)n1
InChIInChI=1S/C11H16N4S/c1-3-15-5-4-13-11(15)6-9(12)10-7-16-8(2)14-10/h4-5,7,9H,3,6,12H2,1-2H3
InChIKeyNHRPOPFQXRDHJP-UHFFFAOYSA-N
XLogP1.91
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-ethylimidazol-2-yl)-1-(thiadiazol-4-yl)ethanamine
CID 105165773
2-(1-ethylimidazol-2-yl)-1-quinoxalin-2-ylethanamine
CID 107357294
(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine
CID 92763393
N-[(1-ethylimidazol-2-yl)-(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine
CID 65199087
2-(1-ethylimidazol-2-yl)-1-(4-methylquinolin-2-yl)ethanamine
CID 114755024
2-(1-ethylimidazol-2-yl)-1-(2-methylphenyl)ethanamine
CID 79751911
2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine
CID 79751489
1-(2,5-dimethylphenyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 105009189
1-(3,5-dimethyl-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 113365596
(1S)-1-(2-methyl-1,3-thiazol-4-yl)ethane-1,2-diamine
CID 55296429
2-(1-ethylimidazol-2-yl)-1-(5-fluoro-2-methylphenyl)ethanamine
CID 79751964
2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 105180369

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine (CID 105165882) is 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine is CCn1ccnc1CC(N)c1csc(C)n1.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The InChIKey is NHRPOPFQXRDHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4S/c1-3-15-5-4-13-11(15)6-9(12)10-7-16-8(2)14-10/h4-5,7,9H,3,6,12H2,1-2H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine has a molecular weight of 236.34 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine is sourced from PubChem (CID 105165882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).