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

C11H11N5OS — CID 113286867

IUPAC5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc2nc(N)n(Cc3cscn3)c2n1
InChIInChI=1S/C11H11N5OS/c1-17-9-3-2-8-10(15-9)16(11(12)14-8)4-7-5-18-6-13-7/h2-3,5-6H,4H2,1H3,(H2,12,14)
InChIKeyGOWHTZXTAPMISZ-UHFFFAOYSA-N
MW261.31 g/mol
LogP1.53
Rot. Bonds3

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

5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 113286867) has the molecular formula C11H11N5OS and a molecular weight of 261.31 g/mol. Its IUPAC name is 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine
PubChem CID113286867
Molecular FormulaC11H11N5OS
Molecular Weight261.31 g/mol
Exact Mass261.07
IUPAC Name5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc2nc(N)n(Cc3cscn3)c2n1
InChIInChI=1S/C11H11N5OS/c1-17-9-3-2-8-10(15-9)16(11(12)14-8)4-7-5-18-6-13-7/h2-3,5-6H,4H2,1H3,(H2,12,14)
InChIKeyGOWHTZXTAPMISZ-UHFFFAOYSA-N
XLogP1.53
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.31
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-methoxy-3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 115322294
5-methoxy-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 115322105
3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322450
5-methoxy-3-(2-methoxypropyl)imidazo[4,5-b]pyridin-2-amine
CID 102699356
5-fluoro-6-methoxy-1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-amine
CID 63825511
3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322083
6-fluoro-1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-amine
CID 63825683
5-methoxy-3-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazo[4,5-b]pyridin-2-amine
CID 115322400
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-(cyclohexylmethyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322201
N-[2-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)ethyl]methanesulfonamide
CID 115322213

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine (CID 113286867) is 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine is COc1ccc2nc(N)n(Cc3cscn3)c2n1.
What is the InChIKey of 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is GOWHTZXTAPMISZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5OS/c1-17-9-3-2-8-10(15-9)16(11(12)14-8)4-7-5-18-6-13-7/h2-3,5-6H,4H2,1H3,(H2,12,14).
What are the key properties of 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine?
5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 261.31 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 113286867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).