7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide

C18H20N4O3S — CID 155438506

IUPAC7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1csnc1C
InChIInChI=1S/C18H20N4O3S/c1-11-15(10-26-21-11)20-18(23)13-8-22-9-14(12-3-5-25-6-4-12)19-17(22)7-16(13)24-2/h7-10,12H,3-6H2,1-2H3,(H,20,23)
InChIKeyCPAKDHZTQRSAFA-UHFFFAOYSA-N
MW372.45 g/mol
LogP3.25
Rot. Bonds4

About 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide

7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 155438506) has the molecular formula C18H20N4O3S and a molecular weight of 372.45 g/mol. Its IUPAC name is 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID155438506
Molecular FormulaC18H20N4O3S
Molecular Weight372.45 g/mol
Exact Mass372.13
IUPAC Name7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1csnc1C
InChIInChI=1S/C18H20N4O3S/c1-11-15(10-26-21-11)20-18(23)13-8-22-9-14(12-3-5-25-6-4-12)19-17(22)7-16(13)24-2/h7-10,12H,3-6H2,1-2H3,(H,20,23)
InChIKeyCPAKDHZTQRSAFA-UHFFFAOYSA-N
XLogP3.25
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.45
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide (CID 155438506) is 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide is COc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1csnc1C.
What is the InChIKey of 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is CPAKDHZTQRSAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3S/c1-11-15(10-26-21-11)20-18(23)13-8-22-9-14(12-3-5-25-6-4-12)19-17(22)7-16(13)24-2/h7-10,12H,3-6H2,1-2H3,(H,20,23).
What are the key properties of 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 372.45 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 155438506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).