N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline

C144H93N3O3 — CID 161138706

IUPACN-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5ccc6c7ccc(-c8ccccc8)cc7oc6c45)cc3)cc2)cc1.c1ccc(-c2cccc3oc4c(ccc5cccc(N(c6ccc7c(ccc8ccccc87)c6)c6ccc7ccc8ccccc8c7c6)c54)c23)cc1.c1ccc(-c2cccc3oc4c(ccc5cccc(N(c6ccccc6)c6ccc7c(ccc8ccccc87)c6)c54)c23)cc1
InChIInChI=1S/C52H35NO.C50H31NO.C42H27NO/c1-4-11-36(12-5-1)39-19-27-44(28-20-39)53(45-29-21-40(22-30-45)37-13-6-2-7-14-37)46-31-23-41(24-32-46)47-18-10-17-42-25-34-49-48-33-26-43(38-15-8-3-9-16-38)35-50(48)54-52(49)51(42)47;1-2-10-32(11-3-1)43-17-9-19-47-49(43)44-28-25-36-14-8-18-46(48(36)50(44)52-47)51(38-27-29-42-37(30-38)23-22-33-12-4-6-15-40(33)42)39-26-24-35-21-20-34-13-5-7-16-41(34)45(35)31-39;1-3-11-28(12-4-1)36-18-10-20-39-41(36)37-25-23-30-14-9-19-38(40(30)42(37)44-39)43(32-15-5-2-6-16-32)33-24-26-35-31(27-33)22-21-29-13-7-8-17-34(29)35/h1-35H;1-31H;1-27H
InChIKeyUNDJDELYUOYFPE-UHFFFAOYSA-N
MW1913.35 g/mol
LogP41.55
Rot. Bonds15

About N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline

N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline (PubChem CID 161138706) has the molecular formula C144H93N3O3 and a molecular weight of 1913.35 g/mol. Its IUPAC name is N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline
PubChem CID161138706
Molecular FormulaC144H93N3O3
Molecular Weight1913.35 g/mol
Exact Mass1911.72
IUPAC NameN-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5ccc6c7ccc(-c8ccccc8)cc7oc6c45)cc3)cc2)cc1.c1ccc(-c2cccc3oc4c(ccc5cccc(N(c6ccc7c(ccc8ccccc87)c6)c6ccc7ccc8ccccc8c7c6)c54)c23)cc1.c1ccc(-c2cccc3oc4c(ccc5cccc(N(c6ccccc6)c6ccc7c(ccc8ccccc87)c6)c54)c23)cc1
InChIInChI=1S/C52H35NO.C50H31NO.C42H27NO/c1-4-11-36(12-5-1)39-19-27-44(28-20-39)53(45-29-21-40(22-30-45)37-13-6-2-7-14-37)46-31-23-41(24-32-46)47-18-10-17-42-25-34-49-48-33-26-43(38-15-8-3-9-16-38)35-50(48)54-52(49)51(42)47;1-2-10-32(11-3-1)43-17-9-19-47-49(43)44-28-25-36-14-8-18-46(48(36)50(44)52-47)51(38-27-29-42-37(30-38)23-22-33-12-4-6-15-40(33)42)39-26-24-35-21-20-34-13-5-7-16-41(34)45(35)31-39;1-3-11-28(12-4-1)36-18-10-20-39-41(36)37-25-23-30-14-9-19-38(40(30)42(37)44-39)43(32-15-5-2-6-16-32)33-24-26-35-31(27-33)22-21-29-13-7-8-17-34(29)35/h1-35H;1-31H;1-27H
InChIKeyUNDJDELYUOYFPE-UHFFFAOYSA-N
XLogP41.55
TPSA49.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms150
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001913.35
LogP ≤ 541.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline with MolForge

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Related Compounds

N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine
CID 146861358
N-phenanthren-3-yl-9-phenyl-N-(3-phenylphenyl)naphtho[1,2-b][1]benzofuran-1-amine
CID 146817238
N,N-bis(4-phenylphenyl)-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-amine;N-phenanthren-2-yl-N-phenyl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-amine;N-phenanthren-3-yl-N-phenyl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-amine
CID 165050554
N-phenanthren-2-yl-4-phenyl-N-[4-(6-phenyldibenzofuran-3-yl)phenyl]dibenzofuran-1-amine
CID 176821213
N-phenanthren-2-yl-N-(4-phenanthren-9-ylphenyl)naphtho[1,2-b][1]benzofuran-1-amine
CID 167277912
N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171738577
N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-N-(4-phenanthren-2-ylphenyl)naphthalen-1-amine
CID 167330881
N-(4-dibenzofuran-3-ylphenyl)-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-4-(4-phenylphenyl)aniline
CID 167329609
N-(3-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-N-(4-phenanthren-2-ylphenyl)dibenzofuran-4-amine
CID 166939558
N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-N-(4-phenanthren-2-ylphenyl)-4-phenylaniline
CID 167331023
N-[3-(8-phenylnaphthalen-1-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171738106
N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-3-phenylaniline
CID 167329469

Frequently Asked Questions

What is the IUPAC name of N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline?
The IUPAC name of N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline (CID 161138706) is N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline?
The canonical SMILES for N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5ccc6c7ccc(-c8ccccc8)cc7oc6c45)cc3)cc2)cc1.c1ccc(-c2cccc3oc4c(ccc5cccc(N(c6ccc7c(ccc8ccccc87)c6)c6ccc7ccc8ccccc8c7c6)c54)c23)cc1.c1ccc(-c2cccc3oc4c(ccc5cccc(N(c6ccccc6)c6ccc7c(ccc8ccccc87)c6)c54)c23)cc1.
What is the InChIKey of N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline?
The InChIKey is UNDJDELYUOYFPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H35NO.C50H31NO.C42H27NO/c1-4-11-36(12-5-1)39-19-27-44(28-20-39)53(45-29-21-40(22-30-45)37-13-6-2-7-14-37)46-31-23-41(24-32-46)47-18-10-17-42-25-34-49-48-33-26-43(38-15-8-3-9-16-38)35-50(48)54-52(49)51(42)47;1-2-10-32(11-3-1)43-17-9-19-47-49(43)44-28-25-36-14-8-18-46(48(36)50(44)52-47)51(38-27-29-42-37(30-38)23-22-33-12-4-6-15-40(33)42)39-26-24-35-21-20-34-13-5-7-16-41(34)45(35)31-39;1-3-11-28(12-4-1)36-18-10-20-39-41(36)37-25-23-30-14-9-19-38(40(30)42(37)44-39)43(32-15-5-2-6-16-32)33-24-26-35-31(27-33)22-21-29-13-7-8-17-34(29)35/h1-35H;1-31H;1-27H.
What are the key properties of N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline?
N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline has a molecular weight of 1913.35 g/mol, XLogP of 41.55, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenanthren-2-yl-N,7-diphenylnaphtho[1,2-b][1]benzofuran-1-amine;N-phenanthren-2-yl-N-phenanthren-3-yl-7-phenylnaphtho[1,2-b][1]benzofuran-1-amine;4-phenyl-N-[4-(9-phenylnaphtho[1,2-b][1]benzofuran-1-yl)phenyl]-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 161138706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).