5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine

C12H13N5OS — CID 115322294

IUPAC5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc2nc(N)n(Cc3csc(C)n3)c2n1
InChIInChI=1S/C12H13N5OS/c1-7-14-8(6-19-7)5-17-11-9(15-12(17)13)3-4-10(16-11)18-2/h3-4,6H,5H2,1-2H3,(H2,13,15)
InChIKeyVOEUFYZWTVGUCB-UHFFFAOYSA-N
MW275.34 g/mol
LogP1.84
Rot. Bonds3

About 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine

5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine (PubChem CID 115322294) has the molecular formula C12H13N5OS and a molecular weight of 275.34 g/mol. Its IUPAC name is 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine
PubChem CID115322294
Molecular FormulaC12H13N5OS
Molecular Weight275.34 g/mol
Exact Mass275.08
IUPAC Name5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc2nc(N)n(Cc3csc(C)n3)c2n1
InChIInChI=1S/C12H13N5OS/c1-7-14-8(6-19-7)5-17-11-9(15-12(17)13)3-4-10(16-11)18-2/h3-4,6H,5H2,1-2H3,(H2,13,15)
InChIKeyVOEUFYZWTVGUCB-UHFFFAOYSA-N
XLogP1.84
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.34
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine with MolForge

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Related Compounds

5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 113286867
5-methoxy-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 115322105
5-methoxy-3-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 115322400
3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322450
5-methoxy-3-(3-methylsulfanylpropyl)imidazo[4,5-b]pyridin-2-amine
CID 115322427
5-methoxy-3-[2-(1-methylpyrazol-3-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 106105695
3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322083
3-(cyclohexylmethyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322201
ethyl 4-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)butanoate
CID 115322446
4-[[2-(1-chloroethyl)-5-methylimidazo[4,5-b]pyridin-3-yl]methyl]-2-methyl-1,3-thiazole
CID 81135612
4-[[4-[(6-methoxy-2-pyridinyl)methyl]piperazin-1-yl]methyl]-2-methyl-1,3-thiazole
CID 172891269
3-(2-ethylhexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 107816979

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine (CID 115322294) is 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine is COc1ccc2nc(N)n(Cc3csc(C)n3)c2n1.
What is the InChIKey of 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine?
The InChIKey is VOEUFYZWTVGUCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5OS/c1-7-14-8(6-19-7)5-17-11-9(15-12(17)13)3-4-10(16-11)18-2/h3-4,6H,5H2,1-2H3,(H2,13,15).
What are the key properties of 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine?
5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine has a molecular weight of 275.34 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 115322294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).