2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine

C20H15N3OS — CID 18382869

IUPAC2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine
SMILESCc1cc2cc(Nc3ccnc4cc(-c5ccoc5)sc34)ccc2[nH]1
InChIInChI=1S/C20H15N3OS/c1-12-8-14-9-15(2-3-16(14)22-12)23-17-4-6-21-18-10-19(25-20(17)18)13-5-7-24-11-13/h2-11,22H,1H3,(H,21,23)
InChIKeySVJLHPUNNCJCOV-UHFFFAOYSA-N
MW345.43 g/mol
LogP6.09
Rot. Bonds3

About 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine

2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine (PubChem CID 18382869) has the molecular formula C20H15N3OS and a molecular weight of 345.43 g/mol. Its IUPAC name is 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine.

Molecular Properties

Compound Name2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine
PubChem CID18382869
Molecular FormulaC20H15N3OS
Molecular Weight345.43 g/mol
Exact Mass345.09
IUPAC Name2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine
SMILESCc1cc2cc(Nc3ccnc4cc(-c5ccoc5)sc34)ccc2[nH]1
InChIInChI=1S/C20H15N3OS/c1-12-8-14-9-15(2-3-16(14)22-12)23-17-4-6-21-18-10-19(25-20(17)18)13-5-7-24-11-13/h2-11,22H,1H3,(H,21,23)
InChIKeySVJLHPUNNCJCOV-UHFFFAOYSA-N
XLogP6.09
TPSA53.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.43
LogP ≤ 56.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine?
The IUPAC name of 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine (CID 18382869) is 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine.
What is the SMILES notation for 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine?
The canonical SMILES for 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine is Cc1cc2cc(Nc3ccnc4cc(-c5ccoc5)sc34)ccc2[nH]1.
What is the InChIKey of 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine?
The InChIKey is SVJLHPUNNCJCOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3OS/c1-12-8-14-9-15(2-3-16(14)22-12)23-17-4-6-21-18-10-19(25-20(17)18)13-5-7-24-11-13/h2-11,22H,1H3,(H,21,23).
What are the key properties of 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine?
2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine has a molecular weight of 345.43 g/mol, XLogP of 6.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-N-(2-methyl-1H-indol-5-yl)thieno[3,2-b]pyridin-7-amine is sourced from PubChem (CID 18382869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).