5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine

C10H12N6S — CID 115335314

IUPAC5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine
SMILESCCc1c(N)nnn1Cc1cn2ccsc2n1
InChIInChI=1S/C10H12N6S/c1-2-8-9(11)13-14-16(8)6-7-5-15-3-4-17-10(15)12-7/h3-5H,2,6,11H2,1H3
InChIKeyUQPWNTORJCTNLE-UHFFFAOYSA-N
MW248.31 g/mol
LogP1.18
Rot. Bonds3

About 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine

5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine (PubChem CID 115335314) has the molecular formula C10H12N6S and a molecular weight of 248.31 g/mol. Its IUPAC name is 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine.

Molecular Properties

Compound Name5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine
PubChem CID115335314
Molecular FormulaC10H12N6S
Molecular Weight248.31 g/mol
Exact Mass248.08
IUPAC Name5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine
SMILESCCc1c(N)nnn1Cc1cn2ccsc2n1
InChIInChI=1S/C10H12N6S/c1-2-8-9(11)13-14-16(8)6-7-5-15-3-4-17-10(15)12-7/h3-5H,2,6,11H2,1H3
InChIKeyUQPWNTORJCTNLE-UHFFFAOYSA-N
XLogP1.18
TPSA74.03 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-5-propan-2-yltriazol-4-amine
CID 113289497
1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine
CID 115335312
6-(chloromethyl)imidazo[2,1-b][1,3]thiazole
CID 18804066
6-(chloromethyl)imidazo[2,1-b][1,3]thiazole;hydrochloride
CID 76851866
1-[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-5-methylpyrazol-4-yl]-N-methylmethanamine
CID 113289386
imidazo[2,1-b][1,3]thiazol-6-ylmethylazanium
CID 7062758
6-[2-(chloromethyl)-2-ethylbutyl]imidazo[2,1-b][1,3]thiazole
CID 115335151
1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine
CID 115332589
2-[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-yl]propan-2-ol
CID 113461384
6-[(2,3,4-trimethylpyrrol-1-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 115334565
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methylpentan-2-amine
CID 115333412
2-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine
CID 115334306

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine?
The IUPAC name of 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine (CID 115335314) is 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine.
What is the SMILES notation for 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine?
The canonical SMILES for 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine is CCc1c(N)nnn1Cc1cn2ccsc2n1.
What is the InChIKey of 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine?
The InChIKey is UQPWNTORJCTNLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6S/c1-2-8-9(11)13-14-16(8)6-7-5-15-3-4-17-10(15)12-7/h3-5H,2,6,11H2,1H3.
What are the key properties of 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine?
5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine has a molecular weight of 248.31 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)triazol-4-amine is sourced from PubChem (CID 115335314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).