N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine

C17H12N2O — CID 170177747

IUPACN-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine
SMILESc1ccc(Nc2ccc3c(c2)oc2ncccc23)cc1
InChIInChI=1S/C17H12N2O/c1-2-5-12(6-3-1)19-13-8-9-14-15-7-4-10-18-17(15)20-16(14)11-13/h1-11,19H
InChIKeyWYQIRWZFDXLLAI-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.72
Rot. Bonds2

About N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine

N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine (PubChem CID 170177747) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine.

Molecular Properties

Compound NameN-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine
PubChem CID170177747
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC NameN-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine
SMILESc1ccc(Nc2ccc3c(c2)oc2ncccc23)cc1
InChIInChI=1S/C17H12N2O/c1-2-5-12(6-3-1)19-13-8-9-14-15-7-4-10-18-17(15)20-16(14)11-13/h1-11,19H
InChIKeyWYQIRWZFDXLLAI-UHFFFAOYSA-N
XLogP4.72
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine?
The IUPAC name of N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine (CID 170177747) is N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine.
What is the SMILES notation for N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine?
The canonical SMILES for N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine is c1ccc(Nc2ccc3c(c2)oc2ncccc23)cc1.
What is the InChIKey of N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine?
The InChIKey is WYQIRWZFDXLLAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-2-5-12(6-3-1)19-13-8-9-14-15-7-4-10-18-17(15)20-16(14)11-13/h1-11,19H.
What are the key properties of N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine?
N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine has a molecular weight of 260.30 g/mol, XLogP of 4.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-[1]benzofuro[2,3-b]pyridin-7-amine is sourced from PubChem (CID 170177747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).