N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine

C15H21N5S — CID 61237982

IUPACN-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
SMILESCCNCc1c(-n2nc(C)c(CC)c2C)nc2sccn12
InChIInChI=1S/C15H21N5S/c1-5-12-10(3)18-20(11(12)4)14-13(9-16-6-2)19-7-8-21-15(19)17-14/h7-8,16H,5-6,9H2,1-4H3
InChIKeyKTSIQOMAQVSGDI-UHFFFAOYSA-N
MW303.44 g/mol
LogP2.87
Rot. Bonds5

About N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine

N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine (PubChem CID 61237982) has the molecular formula C15H21N5S and a molecular weight of 303.44 g/mol. Its IUPAC name is N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
PubChem CID61237982
Molecular FormulaC15H21N5S
Molecular Weight303.44 g/mol
Exact Mass303.15
IUPAC NameN-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
SMILESCCNCc1c(-n2nc(C)c(CC)c2C)nc2sccn12
InChIInChI=1S/C15H21N5S/c1-5-12-10(3)18-20(11(12)4)14-13(9-16-6-2)19-7-8-21-15(19)17-14/h7-8,16H,5-6,9H2,1-4H3
InChIKeyKTSIQOMAQVSGDI-UHFFFAOYSA-N
XLogP2.87
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.44
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[6-(4-bromo-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 62129252
N-[[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 62349710
N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 62140386
N-[[6-(3,4-dimethylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 79188181
1-[5-(ethylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]pyrazole-3-carboxamide
CID 64782872
N-[[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine
CID 63071941
N-[(6-methylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63813892
N-[[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)-4,6-dimethyl-3-pyridinyl]methyl]ethanamine
CID 62287573
N-cyclopropyl-N-ethyl-5-(ethylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 43476423
N-[[6-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 64575731
N-[(6-propan-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63808415
2-[1-[5-(ethylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]pyrrolidin-3-yl]ethanol
CID 114798563

Frequently Asked Questions

What is the IUPAC name of N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine?
The IUPAC name of N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine (CID 61237982) is N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine.
What is the SMILES notation for N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine?
The canonical SMILES for N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine is CCNCc1c(-n2nc(C)c(CC)c2C)nc2sccn12.
What is the InChIKey of N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine?
The InChIKey is KTSIQOMAQVSGDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5S/c1-5-12-10(3)18-20(11(12)4)14-13(9-16-6-2)19-7-8-21-15(19)17-14/h7-8,16H,5-6,9H2,1-4H3.
What are the key properties of N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine?
N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine has a molecular weight of 303.44 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine is sourced from PubChem (CID 61237982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).