[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine

C15H14N4S — CID 115334616

IUPAC[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine
SMILESNCc1ccc2ccn(Cc3cn4ccsc4n3)c2c1
InChIInChI=1S/C15H14N4S/c16-8-11-1-2-12-3-4-18(14(12)7-11)9-13-10-19-5-6-20-15(19)17-13/h1-7,10H,8-9,16H2
InChIKeyNQSLXPLPIMDVGH-UHFFFAOYSA-N
MW282.37 g/mol
LogP2.86
Rot. Bonds3

About [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine

[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine (PubChem CID 115334616) has the molecular formula C15H14N4S and a molecular weight of 282.37 g/mol. Its IUPAC name is [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine.

Molecular Properties

Compound Name[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine
PubChem CID115334616
Molecular FormulaC15H14N4S
Molecular Weight282.37 g/mol
Exact Mass282.09
IUPAC Name[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine
SMILESNCc1ccc2ccn(Cc3cn4ccsc4n3)c2c1
InChIInChI=1S/C15H14N4S/c16-8-11-1-2-12-3-4-18(14(12)7-11)9-13-10-19-5-6-20-15(19)17-13/h1-7,10H,8-9,16H2
InChIKeyNQSLXPLPIMDVGH-UHFFFAOYSA-N
XLogP2.86
TPSA48.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(5-bromoindol-1-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 116619522
[3-bromo-4-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]methanamine
CID 115331341
6-[(2-methylimidazol-1-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 78918699
6-[(2,3,4-trimethylpyrrol-1-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 115334565
5-bromo-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyridin-2-one
CID 78942968
[4-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)-3-nitrophenyl]methanamine
CID 115331283
[3-[[6-(aminomethyl)indol-1-yl]methyl]phenyl]methyl carbamate
CID 175555612
1-[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrrol-2-yl]propan-2-amine
CID 115334462
6-(chloromethyl)imidazo[2,1-b][1,3]thiazole
CID 18804066
imidazo[2,1-b][1,3]thiazol-6-ylmethylazanium
CID 7062758
1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine
CID 115332589
[3,5-dibromo-4-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]methanamine
CID 107741325

Frequently Asked Questions

What is the IUPAC name of [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine?
The IUPAC name of [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine (CID 115334616) is [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine.
What is the SMILES notation for [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine?
The canonical SMILES for [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine is NCc1ccc2ccn(Cc3cn4ccsc4n3)c2c1.
What is the InChIKey of [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine?
The InChIKey is NQSLXPLPIMDVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4S/c16-8-11-1-2-12-3-4-18(14(12)7-11)9-13-10-19-5-6-20-15(19)17-13/h1-7,10H,8-9,16H2.
What are the key properties of [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine?
[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine has a molecular weight of 282.37 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)indol-6-yl]methanamine is sourced from PubChem (CID 115334616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).