3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine

C12H11N3OS — CID 82479014

IUPAC3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCOc1ccccc1-c1csc2nc(N)cn12
InChIInChI=1S/C12H11N3OS/c1-16-10-5-3-2-4-8(10)9-7-17-12-14-11(13)6-15(9)12/h2-7H,13H2,1H3
InChIKeyCSCRTKFMWMVKCH-UHFFFAOYSA-N
MW245.31 g/mol
LogP2.65
Rot. Bonds2

About 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine

3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 82479014) has the molecular formula C12H11N3OS and a molecular weight of 245.31 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID82479014
Molecular FormulaC12H11N3OS
Molecular Weight245.31 g/mol
Exact Mass245.06
IUPAC Name3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCOc1ccccc1-c1csc2nc(N)cn12
InChIInChI=1S/C12H11N3OS/c1-16-10-5-3-2-4-8(10)9-7-17-12-14-11(13)6-15(9)12/h2-7H,13H2,1H3
InChIKeyCSCRTKFMWMVKCH-UHFFFAOYSA-N
XLogP2.65
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.31
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine (CID 82479014) is 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine is COc1ccccc1-c1csc2nc(N)cn12.
What is the InChIKey of 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is CSCRTKFMWMVKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3OS/c1-16-10-5-3-2-4-8(10)9-7-17-12-14-11(13)6-15(9)12/h2-7H,13H2,1H3.
What are the key properties of 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine?
3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 245.31 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 82479014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).