2-phenyl-1-benzofuran-3-amine

C14H11NO — CID 54532541

IUPAC2-phenyl-1-benzofuran-3-amine
SMILESNc1c(-c2ccccc2)oc2ccccc12
InChIInChI=1S/C14H11NO/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H,15H2
InChIKeyYXNJHDGDEUHZPH-UHFFFAOYSA-N
MW209.25 g/mol
LogP3.68
Rot. Bonds1

About 2-phenyl-1-benzofuran-3-amine

2-phenyl-1-benzofuran-3-amine (PubChem CID 54532541) has the molecular formula C14H11NO and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-phenyl-1-benzofuran-3-amine.

Molecular Properties

Compound Name2-phenyl-1-benzofuran-3-amine
PubChem CID54532541
Molecular FormulaC14H11NO
Molecular Weight209.25 g/mol
Exact Mass209.08
IUPAC Name2-phenyl-1-benzofuran-3-amine
SMILESNc1c(-c2ccccc2)oc2ccccc12
InChIInChI=1S/C14H11NO/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H,15H2
InChIKeyYXNJHDGDEUHZPH-UHFFFAOYSA-N
XLogP3.68
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-benzofuran-3-amine?
The IUPAC name of 2-phenyl-1-benzofuran-3-amine (CID 54532541) is 2-phenyl-1-benzofuran-3-amine.
What is the SMILES notation for 2-phenyl-1-benzofuran-3-amine?
The canonical SMILES for 2-phenyl-1-benzofuran-3-amine is Nc1c(-c2ccccc2)oc2ccccc12.
What is the InChIKey of 2-phenyl-1-benzofuran-3-amine?
The InChIKey is YXNJHDGDEUHZPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H,15H2.
What are the key properties of 2-phenyl-1-benzofuran-3-amine?
2-phenyl-1-benzofuran-3-amine has a molecular weight of 209.25 g/mol, XLogP of 3.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-benzofuran-3-amine is sourced from PubChem (CID 54532541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).