N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine

C33H22N2O — CID 168737853

IUPACN-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4ccccc4c3)c3cnc4oc5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C33H22N2O/c1-2-8-23(9-3-1)25-14-17-27(18-15-25)35(28-19-16-24-10-4-5-11-26(24)20-28)29-21-31-30-12-6-7-13-32(30)36-33(31)34-22-29/h1-22H
InChIKeyTVQKAADHQUOSSI-UHFFFAOYSA-N
MW462.55 g/mol
LogP9.27
Rot. Bonds4

About N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine

N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine (PubChem CID 168737853) has the molecular formula C33H22N2O and a molecular weight of 462.55 g/mol. Its IUPAC name is N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine
PubChem CID168737853
Molecular FormulaC33H22N2O
Molecular Weight462.55 g/mol
Exact Mass462.17
IUPAC NameN-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4ccccc4c3)c3cnc4oc5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C33H22N2O/c1-2-8-23(9-3-1)25-14-17-27(18-15-25)35(28-19-16-24-10-4-5-11-26(24)20-28)29-21-31-30-12-6-7-13-32(30)36-33(31)34-22-29/h1-22H
InChIKeyTVQKAADHQUOSSI-UHFFFAOYSA-N
XLogP9.27
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.55
LogP ≤ 59.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]naphthalen-2-amine
CID 118405802
N-(6-naphthalen-2-ylnaphthalen-2-yl)-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 176587573
3-([1]benzofuro[2,3-b]pyridin-3-yl)-N,N-diphenylaniline
CID 160692171
N-(4-dibenzofuran-4-ylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 118405762
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-N-phenyldibenzofuran-2-amine
CID 174256821
3-[3-[3,5-di(dibenzofuran-3-yl)phenyl]phenyl]-N,N-bis(4-phenylphenyl)aniline;N-[3-[3-[3,5-di(dibenzofuran-3-yl)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine;3-[3-[3,5-di(dibenzofuran-3-yl)phenyl]phenyl]-N-phenyl-N-(4-phenylphenyl)aniline
CID 158904441
N-[4-[4-(4-dibenzofuran-3-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]-N-(4-dibenzofuran-3-ylphenyl)naphthalen-2-amine
CID 122533769
N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine
CID 121325434
3-N,7-N-di(dibenzofuran-3-yl)-3-N,7-N-bis(4-phenylphenyl)-[1]benzofuro[3,2-b]pyridine-3,7-diamine
CID 164813283
N-(4-dibenzofuran-3-ylphenyl)-3-naphthalen-2-yl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167324392
3-dibenzofuran-2-yl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline
CID 170535051
N-(4-dibenzofuran-3-ylphenyl)-3-naphthalen-2-yl-N-phenylaniline
CID 167324119

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine?
The IUPAC name of N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine (CID 168737853) is N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine.
What is the SMILES notation for N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine?
The canonical SMILES for N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine is c1ccc(-c2ccc(N(c3ccc4ccccc4c3)c3cnc4oc5ccccc5c4c3)cc2)cc1.
What is the InChIKey of N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine?
The InChIKey is TVQKAADHQUOSSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H22N2O/c1-2-8-23(9-3-1)25-14-17-27(18-15-25)35(28-19-16-24-10-4-5-11-26(24)20-28)29-21-31-30-12-6-7-13-32(30)36-33(31)34-22-29/h1-22H.
What are the key properties of N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine?
N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine has a molecular weight of 462.55 g/mol, XLogP of 9.27, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-N-(4-phenylphenyl)-[1]benzofuro[2,3-b]pyridin-3-amine is sourced from PubChem (CID 168737853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).