N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine

C15H15N5S — CID 62140386

IUPACN-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
SMILESCCNCc1c(-n2ncc3ccccc32)nc2sccn12
InChIInChI=1S/C15H15N5S/c1-2-16-10-13-14(18-15-19(13)7-8-21-15)20-12-6-4-3-5-11(12)9-17-20/h3-9,16H,2,10H2,1H3
InChIKeyTYLVRTWIRNHNIL-UHFFFAOYSA-N
MW297.39 g/mol
LogP2.84
Rot. Bonds4

About N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine

N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine (PubChem CID 62140386) has the molecular formula C15H15N5S and a molecular weight of 297.39 g/mol. Its IUPAC name is N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
PubChem CID62140386
Molecular FormulaC15H15N5S
Molecular Weight297.39 g/mol
Exact Mass297.10
IUPAC NameN-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
SMILESCCNCc1c(-n2ncc3ccccc32)nc2sccn12
InChIInChI=1S/C15H15N5S/c1-2-16-10-13-14(18-15-19(13)7-8-21-15)20-12-6-4-3-5-11(12)9-17-20/h3-9,16H,2,10H2,1H3
InChIKeyTYLVRTWIRNHNIL-UHFFFAOYSA-N
XLogP2.84
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.39
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 62349710
N-[[6-(4-ethyl-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 61237982
N-[[6-(4-bromo-3,5-dimethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 62129252
N-[[6-(3,4-dimethylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 79188181
N-[(6-methylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63813892
1-[5-(ethylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]pyrazole-3-carboxamide
CID 64782872
N-[[6-(2-methoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 43476724
N-[[6-(3,4,5-trimethylpiperazin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 114538713
N-[(6-indazol-1-yl-3-pyridinyl)methyl]ethanamine
CID 62292876
N-[(4-indazol-1-yl-3-pyridinyl)methyl]ethanamine
CID 81255177
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

Frequently Asked Questions

What is the IUPAC name of N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine?
The IUPAC name of N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine (CID 62140386) is N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine.
What is the SMILES notation for N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine?
The canonical SMILES for N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine is CCNCc1c(-n2ncc3ccccc32)nc2sccn12.
What is the InChIKey of N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine?
The InChIKey is TYLVRTWIRNHNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5S/c1-2-16-10-13-14(18-15-19(13)7-8-21-15)20-12-6-4-3-5-11(12)9-17-20/h3-9,16H,2,10H2,1H3.
What are the key properties of N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine?
N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine has a molecular weight of 297.39 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-indazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 62140386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).