7-phenyl-4,4a-dihydrodibenzofuran-1-amine

C18H15NO — CID 138670828

IUPAC7-phenyl-4,4a-dihydrodibenzofuran-1-amine
SMILESNC1=C2c3ccc(-c4ccccc4)cc3OC2CC=C1
InChIInChI=1S/C18H15NO/c19-15-7-4-8-16-18(15)14-10-9-13(11-17(14)20-16)12-5-2-1-3-6-12/h1-7,9-11,16H,8,19H2
InChIKeyHOXBEUQATKJGIC-UHFFFAOYSA-N
MW261.32 g/mol
LogP3.74
Rot. Bonds1

About 7-phenyl-4,4a-dihydrodibenzofuran-1-amine

7-phenyl-4,4a-dihydrodibenzofuran-1-amine (PubChem CID 138670828) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 7-phenyl-4,4a-dihydrodibenzofuran-1-amine.

Molecular Properties

Compound Name7-phenyl-4,4a-dihydrodibenzofuran-1-amine
PubChem CID138670828
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name7-phenyl-4,4a-dihydrodibenzofuran-1-amine
SMILESNC1=C2c3ccc(-c4ccccc4)cc3OC2CC=C1
InChIInChI=1S/C18H15NO/c19-15-7-4-8-16-18(15)14-10-9-13(11-17(14)20-16)12-5-2-1-3-6-12/h1-7,9-11,16H,8,19H2
InChIKeyHOXBEUQATKJGIC-UHFFFAOYSA-N
XLogP3.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;methanamine;2-phenyldibenzo-p-dioxin
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CID 135036112
N-(4-dibenzofuran-2-ylcyclohexa-1,3-dien-1-yl)-4,4a-dihydrodibenzofuran-1-amine
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CID 153492708
3,3'-diphenyl-9,9'-spirobi[xanthene]
CID 118698118
3-[6-(9-bromo-5a,6-dihydrodibenzofuran-2-yl)-9-phenyl-9,10-dihydrophenanthren-3-yl]-9-phenylcarbazole
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Frequently Asked Questions

What is the IUPAC name of 7-phenyl-4,4a-dihydrodibenzofuran-1-amine?
The IUPAC name of 7-phenyl-4,4a-dihydrodibenzofuran-1-amine (CID 138670828) is 7-phenyl-4,4a-dihydrodibenzofuran-1-amine.
What is the SMILES notation for 7-phenyl-4,4a-dihydrodibenzofuran-1-amine?
The canonical SMILES for 7-phenyl-4,4a-dihydrodibenzofuran-1-amine is NC1=C2c3ccc(-c4ccccc4)cc3OC2CC=C1.
What is the InChIKey of 7-phenyl-4,4a-dihydrodibenzofuran-1-amine?
The InChIKey is HOXBEUQATKJGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO/c19-15-7-4-8-16-18(15)14-10-9-13(11-17(14)20-16)12-5-2-1-3-6-12/h1-7,9-11,16H,8,19H2.
What are the key properties of 7-phenyl-4,4a-dihydrodibenzofuran-1-amine?
7-phenyl-4,4a-dihydrodibenzofuran-1-amine has a molecular weight of 261.32 g/mol, XLogP of 3.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-4,4a-dihydrodibenzofuran-1-amine is sourced from PubChem (CID 138670828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).