methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate

C10H10N2O3S — CID 10799938

IUPACmethyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate
SMILESCOC(=O)c1sc2c(OC)ccnc2c1N
InChIInChI=1S/C10H10N2O3S/c1-14-5-3-4-12-7-6(11)9(10(13)15-2)16-8(5)7/h3-4H,11H2,1-2H3
InChIKeyDAVIWKLSMZNVHS-UHFFFAOYSA-N
MW238.27 g/mol
LogP1.67
Rot. Bonds2

About methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate

methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate (PubChem CID 10799938) has the molecular formula C10H10N2O3S and a molecular weight of 238.27 g/mol. Its IUPAC name is methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate
PubChem CID10799938
Molecular FormulaC10H10N2O3S
Molecular Weight238.27 g/mol
Exact Mass238.04
IUPAC Namemethyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate
SMILESCOC(=O)c1sc2c(OC)ccnc2c1N
InChIInChI=1S/C10H10N2O3S/c1-14-5-3-4-12-7-6(11)9(10(13)15-2)16-8(5)7/h3-4H,11H2,1-2H3
InChIKeyDAVIWKLSMZNVHS-UHFFFAOYSA-N
XLogP1.67
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.27
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Methyl 3-amino-6-[2-(4-methoxyphenyl)ethynyl]thieno[3,2-b]pyridine-2-carboxylate
CID 50994345
Methyl 3-(2-amino-4-methoxyanilino)thieno[3,2-b]pyridine-2-carboxylate
CID 73357133
(2R)-2-amino-3-[(7-propan-2-yloxythieno[3,2-b]pyridine-2-carbonyl)amino]propanoic acid
CID 155457931
Methyl 3-aminothieno[3,2-b]pyridine-2-carboxylate
CID 13793447
Methyl 3-amino-6-(4-methoxyphenyl)thieno[3,2-b]pyridine-2-carboxylate
CID 50905126
Methyl 3-amino-6-(4-methoxyanilino)thieno[3,2-b]pyridine-2-carboxylate
CID 50906649
Methyl 3-amino-6-(2,4-dimethoxyanilino)thieno[3,2-b]pyridine-2-carboxylate
CID 50906856
Methyl 3-amino-6-(3,4-dimethoxyanilino)thieno[3,2-b]pyridine-2-carboxylate
CID 50906857
Methyl 3-amino-6-(3,5-dimethoxyanilino)thieno[3,2-b]pyridine-2-carboxylate
CID 50906858
Methyl 3-amino-6-(2-chloro-5-methoxyanilino)thieno[3,2-b]pyridine-2-carboxylate
CID 50906859
Methyl 3-amino-6-(pyridin-3-ylamino)thieno[3,2-b]pyridine-2-carboxylate
CID 50907062
Methyl 3-amino-6-pyridin-3-ylthieno[3,2-b]pyridine-2-carboxylate
CID 50908126

Frequently Asked Questions

What is the IUPAC name of methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate?
The IUPAC name of methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate (CID 10799938) is methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate.
What is the SMILES notation for methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate?
The canonical SMILES for methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate is COC(=O)c1sc2c(OC)ccnc2c1N.
What is the InChIKey of methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate?
The InChIKey is DAVIWKLSMZNVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3S/c1-14-5-3-4-12-7-6(11)9(10(13)15-2)16-8(5)7/h3-4H,11H2,1-2H3.
What are the key properties of methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate?
methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate has a molecular weight of 238.27 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-amino-7-methoxythieno[3,2-b]pyridine-2-carboxylate is sourced from PubChem (CID 10799938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).