4-phenyldibenzofuran-1-amine

C18H13NO — CID 175743038

IUPAC4-phenyldibenzofuran-1-amine
SMILESNc1ccc(-c2ccccc2)c2oc3ccccc3c12
InChIInChI=1S/C18H13NO/c19-15-11-10-13(12-6-2-1-3-7-12)18-17(15)14-8-4-5-9-16(14)20-18/h1-11H,19H2
InChIKeySZSXHIGWWPFKHN-UHFFFAOYSA-N
MW259.31 g/mol
LogP4.84
Rot. Bonds1

About 4-phenyldibenzofuran-1-amine

4-phenyldibenzofuran-1-amine (PubChem CID 175743038) has the molecular formula C18H13NO and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-phenyldibenzofuran-1-amine.

Molecular Properties

Compound Name4-phenyldibenzofuran-1-amine
PubChem CID175743038
Molecular FormulaC18H13NO
Molecular Weight259.31 g/mol
Exact Mass259.10
IUPAC Name4-phenyldibenzofuran-1-amine
SMILESNc1ccc(-c2ccccc2)c2oc3ccccc3c12
InChIInChI=1S/C18H13NO/c19-15-11-10-13(12-6-2-1-3-7-12)18-17(15)14-8-4-5-9-16(14)20-18/h1-11H,19H2
InChIKeySZSXHIGWWPFKHN-UHFFFAOYSA-N
XLogP4.84
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-(4-phenylphenyl)dibenzofuran-4-amine
CID 121250061
1-(2-phenylphenyl)dibenzofuran-4-amine
CID 140757052
2,4-diphenyl-6-[4-(4-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazine
CID 142491264
1,6-diphenyldibenzofuran
CID 145331756
2-dibenzofuran-4-yl-3-phenyl-4-(4-phenylphenyl)aniline
CID 175746284
1,1'-biphenyl;dibenzofuran-4-amine
CID 144554378
2,4-diphenyl-6-[3-(4-phenyldibenzofuran-1-yl)phenyl]-1,3,5-triazine
CID 130289437
N-[4-(1-bromodibenzofuran-4-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 142750812
4-fluoro-1-(2-phenylphenyl)dibenzofuran
CID 146490411
2-phenyl-4-(4-phenyldibenzofuran-1-yl)-6-(6-phenyldibenzofuran-1-yl)-1,3,5-triazine
CID 155477197
1-iodo-2-phenyldibenzofuran
CID 166694702
1-(4-bromophenyl)-4-(4-chlorophenyl)dibenzofuran
CID 162517717

Frequently Asked Questions

What is the IUPAC name of 4-phenyldibenzofuran-1-amine?
The IUPAC name of 4-phenyldibenzofuran-1-amine (CID 175743038) is 4-phenyldibenzofuran-1-amine.
What is the SMILES notation for 4-phenyldibenzofuran-1-amine?
The canonical SMILES for 4-phenyldibenzofuran-1-amine is Nc1ccc(-c2ccccc2)c2oc3ccccc3c12.
What is the InChIKey of 4-phenyldibenzofuran-1-amine?
The InChIKey is SZSXHIGWWPFKHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO/c19-15-11-10-13(12-6-2-1-3-7-12)18-17(15)14-8-4-5-9-16(14)20-18/h1-11H,19H2.
What are the key properties of 4-phenyldibenzofuran-1-amine?
4-phenyldibenzofuran-1-amine has a molecular weight of 259.31 g/mol, XLogP of 4.84, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyldibenzofuran-1-amine is sourced from PubChem (CID 175743038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).