[6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine

C14H15N3O3S — CID 43476612

IUPAC[6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCOc1cccc(OC)c1Oc1nc2sccn2c1CN
InChIInChI=1S/C14H15N3O3S/c1-18-10-4-3-5-11(19-2)12(10)20-13-9(8-15)17-6-7-21-14(17)16-13/h3-7H,8,15H2,1-2H3
InChIKeyNDZNABSRGYVXCR-UHFFFAOYSA-N
MW305.36 g/mol
LogP2.66
Rot. Bonds5

About [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine

[6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine (PubChem CID 43476612) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
PubChem CID43476612
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC Name[6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCOc1cccc(OC)c1Oc1nc2sccn2c1CN
InChIInChI=1S/C14H15N3O3S/c1-18-10-4-3-5-11(19-2)12(10)20-13-9(8-15)17-6-7-21-14(17)16-13/h3-7H,8,15H2,1-2H3
InChIKeyNDZNABSRGYVXCR-UHFFFAOYSA-N
XLogP2.66
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The IUPAC name of [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine (CID 43476612) is [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine.
What is the SMILES notation for [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The canonical SMILES for [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine is COc1cccc(OC)c1Oc1nc2sccn2c1CN.
What is the InChIKey of [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The InChIKey is NDZNABSRGYVXCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-18-10-4-3-5-11(19-2)12(10)20-13-9(8-15)17-6-7-21-14(17)16-13/h3-7H,8,15H2,1-2H3.
What are the key properties of [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
[6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine has a molecular weight of 305.36 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,6-dimethoxyphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine is sourced from PubChem (CID 43476612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).