N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine

C52H33NO2 — CID 167144500

IUPACN-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
SMILESc1ccc(-c2cccc(-c3cccc4c3oc3c5ccccc5c(N(c5cccc(-c6ccccc6)c5)c5ccc6c(c5)oc5ccccc56)cc43)c2)cc1
InChIInChI=1S/C52H33NO2/c1-3-14-34(15-4-1)36-18-11-20-38(30-36)41-25-13-26-46-47-33-48(42-22-7-8-24-45(42)52(47)55-51(41)46)53(39-21-12-19-37(31-39)35-16-5-2-6-17-35)40-28-29-44-43-23-9-10-27-49(43)54-50(44)32-40/h1-33H
InChIKeyRXHKEZZBDDWTME-UHFFFAOYSA-N
MW703.84 g/mol
LogP15.11
Rot. Bonds6

About N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine

N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine (PubChem CID 167144500) has the molecular formula C52H33NO2 and a molecular weight of 703.84 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
PubChem CID167144500
Molecular FormulaC52H33NO2
Molecular Weight703.84 g/mol
Exact Mass703.25
IUPAC NameN-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
SMILESc1ccc(-c2cccc(-c3cccc4c3oc3c5ccccc5c(N(c5cccc(-c6ccccc6)c5)c5ccc6c(c5)oc5ccccc56)cc43)c2)cc1
InChIInChI=1S/C52H33NO2/c1-3-14-34(15-4-1)36-18-11-20-38(30-36)41-25-13-26-46-47-33-48(42-22-7-8-24-45(42)52(47)55-51(41)46)53(39-21-12-19-37(31-39)35-16-5-2-6-17-35)40-28-29-44-43-23-9-10-27-49(43)54-50(44)32-40/h1-33H
InChIKeyRXHKEZZBDDWTME-UHFFFAOYSA-N
XLogP15.11
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500703.84
LogP ≤ 515.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-3-yl-N-(3-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)dibenzofuran-4-amine
CID 167397702
N-phenyl-N-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
CID 90262621
2-(3-dibenzofuran-4-ylphenyl)-N,N-bis(3-phenylphenyl)aniline
CID 126709658
N-dibenzofuran-3-yl-N-[4-(4-dibenzofuran-3-ylphenyl)phenyl]-6-phenyldibenzofuran-4-amine
CID 167397866
N-(3-naphthalen-1-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-5-amine
CID 167277566
N-dibenzofuran-3-yl-N-[4-(6-phenyldibenzofuran-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-4-phenyl-N-[4-[3-(6-phenyldibenzofuran-4-yl)phenyl]phenyl]aniline;3-(6-phenyldibenzofuran-4-yl)-N,N-bis(4-phenylphenyl)aniline;N-[4-(6-phenyldibenzofuran-4-yl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine;N-[4-[4-[3-(6-phenyldibenzofuran-4-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 160949649
N-phenyl-N-[4-(5-phenylnaphtho[1,2-b][1]benzofuran-10-yl)phenyl]dibenzofuran-3-amine
CID 167143711
N-dibenzofuran-3-yl-N-[3-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-18-yl)phenyl]dibenzofuran-3-amine
CID 164980239
N-dibenzofuran-3-yl-N-[4-(6-phenyldibenzofuran-4-yl)phenyl]dibenzofuran-3-amine
CID 121296704
N-dibenzofuran-3-yl-N,5-diphenylnaphtho[1,2-b][1]benzofuran-10-amine
CID 167144409
N-(4-phenanthren-2-ylphenyl)-10-phenyl-N-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine
CID 167144378
N-(17-pentacyclo[12.7.1.02,7.08,13.018,22]docosa-1(21),2,4,6,8,10,12,14(22),15,17,19-undecaenyl)-N-(3-phenylphenyl)dibenzofuran-3-amine
CID 156512739

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine?
The IUPAC name of N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine (CID 167144500) is N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine.
What is the SMILES notation for N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine?
The canonical SMILES for N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine is c1ccc(-c2cccc(-c3cccc4c3oc3c5ccccc5c(N(c5cccc(-c6ccccc6)c5)c5ccc6c(c5)oc5ccccc56)cc43)c2)cc1.
What is the InChIKey of N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine?
The InChIKey is RXHKEZZBDDWTME-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H33NO2/c1-3-14-34(15-4-1)36-18-11-20-38(30-36)41-25-13-26-46-47-33-48(42-22-7-8-24-45(42)52(47)55-51(41)46)53(39-21-12-19-37(31-39)35-16-5-2-6-17-35)40-28-29-44-43-23-9-10-27-49(43)54-50(44)32-40/h1-33H.
What are the key properties of N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine?
N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine has a molecular weight of 703.84 g/mol, XLogP of 15.11, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-N,10-bis(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-amine is sourced from PubChem (CID 167144500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).