N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine

C38H25NO — CID 167325268

IUPACN-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine
SMILESc1ccc(N(c2cccc3ccccc23)c2cccc3ccccc23)c(-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C38H25NO/c1-3-15-29-26(11-1)13-9-20-35(29)39(36-21-10-14-27-12-2-4-16-30(27)36)34-19-7-5-17-31(34)28-23-24-38-33(25-28)32-18-6-8-22-37(32)40-38/h1-25H
InChIKeyFJTWSAJAHHDTRO-UHFFFAOYSA-N
MW511.62 g/mol
LogP11.03
Rot. Bonds4

About N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine

N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine (PubChem CID 167325268) has the molecular formula C38H25NO and a molecular weight of 511.62 g/mol. Its IUPAC name is N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine.

Molecular Properties

Compound NameN-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine
PubChem CID167325268
Molecular FormulaC38H25NO
Molecular Weight511.62 g/mol
Exact Mass511.19
IUPAC NameN-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine
SMILESc1ccc(N(c2cccc3ccccc23)c2cccc3ccccc23)c(-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C38H25NO/c1-3-15-29-26(11-1)13-9-20-35(29)39(36-21-10-14-27-12-2-4-16-30(27)36)34-19-7-5-17-31(34)28-23-24-38-33(25-28)32-18-6-8-22-37(32)40-38/h1-25H
InChIKeyFJTWSAJAHHDTRO-UHFFFAOYSA-N
XLogP11.03
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms40
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500511.62
LogP ≤ 511.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine?
The IUPAC name of N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine (CID 167325268) is N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine.
What is the SMILES notation for N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine?
The canonical SMILES for N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine is c1ccc(N(c2cccc3ccccc23)c2cccc3ccccc23)c(-c2ccc3oc4ccccc4c3c2)c1.
What is the InChIKey of N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine?
The InChIKey is FJTWSAJAHHDTRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25NO/c1-3-15-29-26(11-1)13-9-20-35(29)39(36-21-10-14-27-12-2-4-16-30(27)36)34-19-7-5-17-31(34)28-23-24-38-33(25-28)32-18-6-8-22-37(32)40-38/h1-25H.
What are the key properties of N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine?
N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine has a molecular weight of 511.62 g/mol, XLogP of 11.03, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-dibenzofuran-2-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine is sourced from PubChem (CID 167325268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).