[1]benzofuro[2,3-b]pyridin-3-amine

C11H8N2O — CID 68618520

IUPAC[1]benzofuro[2,3-b]pyridin-3-amine
SMILESNc1cnc2oc3ccccc3c2c1
InChIInChI=1S/C11H8N2O/c12-7-5-9-8-3-1-2-4-10(8)14-11(9)13-6-7/h1-6H,12H2
InChIKeyVVXRYCWDXWVCHP-UHFFFAOYSA-N
MW184.20 g/mol
LogP2.56
Rot. Bonds

About [1]benzofuro[2,3-b]pyridin-3-amine

[1]benzofuro[2,3-b]pyridin-3-amine (PubChem CID 68618520) has the molecular formula C11H8N2O and a molecular weight of 184.20 g/mol. Its IUPAC name is [1]benzofuro[2,3-b]pyridin-3-amine.

Molecular Properties

Compound Name[1]benzofuro[2,3-b]pyridin-3-amine
PubChem CID68618520
Molecular FormulaC11H8N2O
Molecular Weight184.20 g/mol
Exact Mass184.06
IUPAC Name[1]benzofuro[2,3-b]pyridin-3-amine
SMILESNc1cnc2oc3ccccc3c2c1
InChIInChI=1S/C11H8N2O/c12-7-5-9-8-3-1-2-4-10(8)14-11(9)13-6-7/h1-6H,12H2
InChIKeyVVXRYCWDXWVCHP-UHFFFAOYSA-N
XLogP2.56
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1]benzofuro[2,3-b]pyridin-3-amine?
The IUPAC name of [1]benzofuro[2,3-b]pyridin-3-amine (CID 68618520) is [1]benzofuro[2,3-b]pyridin-3-amine.
What is the SMILES notation for [1]benzofuro[2,3-b]pyridin-3-amine?
The canonical SMILES for [1]benzofuro[2,3-b]pyridin-3-amine is Nc1cnc2oc3ccccc3c2c1.
What is the InChIKey of [1]benzofuro[2,3-b]pyridin-3-amine?
The InChIKey is VVXRYCWDXWVCHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O/c12-7-5-9-8-3-1-2-4-10(8)14-11(9)13-6-7/h1-6H,12H2.
What are the key properties of [1]benzofuro[2,3-b]pyridin-3-amine?
[1]benzofuro[2,3-b]pyridin-3-amine has a molecular weight of 184.20 g/mol, XLogP of 2.56, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1]benzofuro[2,3-b]pyridin-3-amine is sourced from PubChem (CID 68618520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).