N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine

C24H19NO — CID 142408590

IUPACN-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine
SMILESC1=C(Nc2ccc(-c3ccccc3)cc2)c2c(oc3ccccc23)CC1
InChIInChI=1S/C24H19NO/c1-2-7-17(8-3-1)18-13-15-19(16-14-18)25-21-10-6-12-23-24(21)20-9-4-5-11-22(20)26-23/h1-5,7-11,13-16,25H,6,12H2
InChIKeyLISVIMNIOOEGDQ-UHFFFAOYSA-N
MW337.42 g/mol
LogP6.50
Rot. Bonds3

About N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine

N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine (PubChem CID 142408590) has the molecular formula C24H19NO and a molecular weight of 337.42 g/mol. Its IUPAC name is N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine.

Molecular Properties

Compound NameN-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine
PubChem CID142408590
Molecular FormulaC24H19NO
Molecular Weight337.42 g/mol
Exact Mass337.15
IUPAC NameN-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine
SMILESC1=C(Nc2ccc(-c3ccccc3)cc2)c2c(oc3ccccc23)CC1
InChIInChI=1S/C24H19NO/c1-2-7-17(8-3-1)18-13-15-19(16-14-18)25-21-10-6-12-23-24(21)20-9-4-5-11-22(20)26-23/h1-5,7-11,13-16,25H,6,12H2
InChIKeyLISVIMNIOOEGDQ-UHFFFAOYSA-N
XLogP6.50
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.42
LogP ≤ 56.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine?
The IUPAC name of N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine (CID 142408590) is N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine.
What is the SMILES notation for N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine?
The canonical SMILES for N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine is C1=C(Nc2ccc(-c3ccccc3)cc2)c2c(oc3ccccc23)CC1.
What is the InChIKey of N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine?
The InChIKey is LISVIMNIOOEGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO/c1-2-7-17(8-3-1)18-13-15-19(16-14-18)25-21-10-6-12-23-24(21)20-9-4-5-11-22(20)26-23/h1-5,7-11,13-16,25H,6,12H2.
What are the key properties of N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine?
N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine has a molecular weight of 337.42 g/mol, XLogP of 6.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylphenyl)-3,4-dihydrodibenzofuran-1-amine is sourced from PubChem (CID 142408590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).