N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine

C39H27NO — CID 164774292

IUPACN-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine
SMILESCc1ccc(N(c2ccc3oc4ccccc4c3c2)c2ccc3ccccc3c2-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C39H27NO/c1-26-14-19-31(20-15-26)40(32-21-23-38-35(25-32)34-12-6-7-13-37(34)41-38)36-22-18-28-9-4-5-11-33(28)39(36)30-17-16-27-8-2-3-10-29(27)24-30/h2-25H,1H3
InChIKeyDXGBGTSIBOQTES-UHFFFAOYSA-N
MW525.65 g/mol
LogP11.34
Rot. Bonds4

About N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine

N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine (PubChem CID 164774292) has the molecular formula C39H27NO and a molecular weight of 525.65 g/mol. Its IUPAC name is N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine.

Molecular Properties

Compound NameN-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine
PubChem CID164774292
Molecular FormulaC39H27NO
Molecular Weight525.65 g/mol
Exact Mass525.21
IUPAC NameN-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine
SMILESCc1ccc(N(c2ccc3oc4ccccc4c3c2)c2ccc3ccccc3c2-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C39H27NO/c1-26-14-19-31(20-15-26)40(32-21-23-38-35(25-32)34-12-6-7-13-37(34)41-38)36-22-18-28-9-4-5-11-33(28)39(36)30-17-16-27-8-2-3-10-29(27)24-30/h2-25H,1H3
InChIKeyDXGBGTSIBOQTES-UHFFFAOYSA-N
XLogP11.34
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500525.65
LogP ≤ 511.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

bis(N-(4-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)dibenzofuran-2-amine);bis(N-(4-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)dibenzofuran-3-amine)
CID 165020534
N-(4-dibenzofuran-2-ylphenyl)-11,11-dimethyl-N-(1-naphthalen-2-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine
CID 164774715
N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine
CID 121325434
N-(2-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(3-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine;N-(3-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-3-amine;N-(3-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(1-naphthalen-2-ylnaphthalen-2-yl)-N-phenyldibenzofuran-1-amine
CID 164992750
1-dibenzofuran-3-yl-6-[4-[3-[N-(1-dibenzofuran-3-ylnaphthalen-2-yl)-4-(4-phenylphenyl)anilino]phenyl]phenyl]-N-(3-phenylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 156522847
N-naphthalen-1-yl-N-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]dibenzofuran-2-amine
CID 174256439
N-chrysen-3-yl-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine
CID 170130661
N-dibenzofuran-1-yl-N-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine
CID 121325423
N,N-bis(3-methylphenyl)-1-naphthalen-2-ylnaphthalen-2-amine;N,N-bis(4-methylphenyl)-1-naphthalen-2-ylnaphthalen-2-amine;N-(4-methoxyphenyl)-N-(4-methylphenyl)-1-naphthalen-2-ylnaphthalen-2-amine;N-(4-methoxyphenyl)-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine;N-(4-methylphenyl)-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine
CID 165046285
1-(4-naphthalen-2-ylphenyl)-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine
CID 177281230
N-naphthalen-1-yl-1-naphthalen-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 177280879
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-N-phenyldibenzofuran-2-amine
CID 174256821

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine?
The IUPAC name of N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine (CID 164774292) is N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine.
What is the SMILES notation for N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine?
The canonical SMILES for N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine is Cc1ccc(N(c2ccc3oc4ccccc4c3c2)c2ccc3ccccc3c2-c2ccc3ccccc3c2)cc1.
What is the InChIKey of N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine?
The InChIKey is DXGBGTSIBOQTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H27NO/c1-26-14-19-31(20-15-26)40(32-21-23-38-35(25-32)34-12-6-7-13-37(34)41-38)36-22-18-28-9-4-5-11-33(28)39(36)30-17-16-27-8-2-3-10-29(27)24-30/h2-25H,1H3.
What are the key properties of N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine?
N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine has a molecular weight of 525.65 g/mol, XLogP of 11.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-2-amine is sourced from PubChem (CID 164774292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).