3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide

C12H15N3O2S — CID 58318955

IUPAC3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide
SMILESCCc1c(OC)nc2sc(C(N)=O)c(N)c2c1C
InChIInChI=1S/C12H15N3O2S/c1-4-6-5(2)7-8(13)9(10(14)16)18-12(7)15-11(6)17-3/h4,13H2,1-3H3,(H2,14,16)
InChIKeyBUNBTPDNYANTBQ-UHFFFAOYSA-N
MW265.34 g/mol
LogP1.86
Rot. Bonds3

About 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide

3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 58318955) has the molecular formula C12H15N3O2S and a molecular weight of 265.34 g/mol. Its IUPAC name is 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide
PubChem CID58318955
Molecular FormulaC12H15N3O2S
Molecular Weight265.34 g/mol
Exact Mass265.09
IUPAC Name3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide
SMILESCCc1c(OC)nc2sc(C(N)=O)c(N)c2c1C
InChIInChI=1S/C12H15N3O2S/c1-4-6-5(2)7-8(13)9(10(14)16)18-12(7)15-11(6)17-3/h4,13H2,1-3H3,(H2,14,16)
InChIKeyBUNBTPDNYANTBQ-UHFFFAOYSA-N
XLogP1.86
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide (CID 58318955) is 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide is CCc1c(OC)nc2sc(C(N)=O)c(N)c2c1C.
What is the InChIKey of 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is BUNBTPDNYANTBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2S/c1-4-6-5(2)7-8(13)9(10(14)16)18-12(7)15-11(6)17-3/h4,13H2,1-3H3,(H2,14,16).
What are the key properties of 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide?
3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 265.34 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-ethyl-6-methoxy-4-methylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 58318955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).