6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine

C15H14FNO2 — CID 55180495

IUPAC6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine
SMILESNC1COc2cc(OCc3ccc(F)cc3)ccc21
InChIInChI=1S/C15H14FNO2/c16-11-3-1-10(2-4-11)8-18-12-5-6-13-14(17)9-19-15(13)7-12/h1-7,14H,8-9,17H2
InChIKeyPCXBIMGLOOUNOR-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.80
Rot. Bonds3

About 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine

6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 55180495) has the molecular formula C15H14FNO2 and a molecular weight of 259.28 g/mol. Its IUPAC name is 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine
PubChem CID55180495
Molecular FormulaC15H14FNO2
Molecular Weight259.28 g/mol
Exact Mass259.10
IUPAC Name6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine
SMILESNC1COc2cc(OCc3ccc(F)cc3)ccc21
InChIInChI=1S/C15H14FNO2/c16-11-3-1-10(2-4-11)8-18-12-5-6-13-14(17)9-19-15(13)7-12/h1-7,14H,8-9,17H2
InChIKeyPCXBIMGLOOUNOR-UHFFFAOYSA-N
XLogP2.80
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine (CID 55180495) is 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine is NC1COc2cc(OCc3ccc(F)cc3)ccc21.
What is the InChIKey of 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is PCXBIMGLOOUNOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO2/c16-11-3-1-10(2-4-11)8-18-12-5-6-13-14(17)9-19-15(13)7-12/h1-7,14H,8-9,17H2.
What are the key properties of 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine?
6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 259.28 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-fluorophenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 55180495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).