2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine

C14H17N3S3 — CID 63804994

IUPAC2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine
SMILESCC(C)(C)NCc1c(Sc2cccs2)nc2sccn12
InChIInChI=1S/C14H17N3S3/c1-14(2,3)15-9-10-12(20-11-5-4-7-18-11)16-13-17(10)6-8-19-13/h4-8,15H,9H2,1-3H3
InChIKeyUAUSWKXHGQRANV-UHFFFAOYSA-N
MW323.51 g/mol
LogP4.50
Rot. Bonds4

About 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine

2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine (PubChem CID 63804994) has the molecular formula C14H17N3S3 and a molecular weight of 323.51 g/mol. Its IUPAC name is 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine
PubChem CID63804994
Molecular FormulaC14H17N3S3
Molecular Weight323.51 g/mol
Exact Mass323.06
IUPAC Name2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine
SMILESCC(C)(C)NCc1c(Sc2cccs2)nc2sccn12
InChIInChI=1S/C14H17N3S3/c1-14(2,3)15-9-10-12(20-11-5-4-7-18-11)16-13-17(10)6-8-19-13/h4-8,15H,9H2,1-3H3
InChIKeyUAUSWKXHGQRANV-UHFFFAOYSA-N
XLogP4.50
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.51
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine with MolForge

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Related Compounds

2-[5-[(tert-butylamino)methyl]imidazo[2,1-b][1,3]thiazol-6-yl]sulfanylethanol
CID 63809975
2-methyl-N-[[6-(3-methylbutan-2-ylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
CID 107761552
2-methyl-N-[(6-pyrazol-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine
CID 63070369
N-[[6-(cyclopentylmethylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 63814081
ethyl 2-[5-[(tert-butylamino)methyl]imidazo[2,1-b][1,3]thiazol-6-yl]sulfanylacetate
CID 63809270
5-[(tert-butylamino)methyl]-N-ethyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 55148570
N-[(6-pyrimidin-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63805833
2-methyl-N-[[6-(3-methylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
CID 63070767
2-methyl-N-[[6-(4-methylpiperazin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
CID 63058722
1-[6-(4,6-dimethylpyrimidin-2-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine
CID 63808078
N-[(6-phenylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-1-amine
CID 63804515
N-[(6-tert-butylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methylpropan-1-amine
CID 63806411

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine (CID 63804994) is 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine is CC(C)(C)NCc1c(Sc2cccs2)nc2sccn12.
What is the InChIKey of 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine?
The InChIKey is UAUSWKXHGQRANV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3S3/c1-14(2,3)15-9-10-12(20-11-5-4-7-18-11)16-13-17(10)6-8-19-13/h4-8,15H,9H2,1-3H3.
What are the key properties of 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine?
2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine has a molecular weight of 323.51 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(6-thiophen-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine is sourced from PubChem (CID 63804994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).