4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine

C19H18N4OS — CID 1117192

IUPAC4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccccc1Nc1nc(-c2c(C)nc3cc(C)ccn23)cs1
InChIInChI=1S/C19H18N4OS/c1-12-8-9-23-17(10-12)20-13(2)18(23)15-11-25-19(22-15)21-14-6-4-5-7-16(14)24-3/h4-11H,1-3H3,(H,21,22)
InChIKeySTNJRVCDHJHREV-UHFFFAOYSA-N
MW350.45 g/mol
LogP4.83
Rot. Bonds4

About 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine

4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 1117192) has the molecular formula C19H18N4OS and a molecular weight of 350.45 g/mol. Its IUPAC name is 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
PubChem CID1117192
Molecular FormulaC19H18N4OS
Molecular Weight350.45 g/mol
Exact Mass350.12
IUPAC Name4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccccc1Nc1nc(-c2c(C)nc3cc(C)ccn23)cs1
InChIInChI=1S/C19H18N4OS/c1-12-8-9-23-17(10-12)20-13(2)18(23)15-11-25-19(22-15)21-14-6-4-5-7-16(14)24-3/h4-11H,1-3H3,(H,21,22)
InChIKeySTNJRVCDHJHREV-UHFFFAOYSA-N
XLogP4.83
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.45
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine (CID 1117192) is 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine is COc1ccccc1Nc1nc(-c2c(C)nc3cc(C)ccn23)cs1.
What is the InChIKey of 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is STNJRVCDHJHREV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4OS/c1-12-8-9-23-17(10-12)20-13(2)18(23)15-11-25-19(22-15)21-14-6-4-5-7-16(14)24-3/h4-11H,1-3H3,(H,21,22).
What are the key properties of 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 350.45 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 1117192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).