9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine

C179H124N8O5 — CID 158448567

IUPAC9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)Oc4ccccc4N5c4ccccc4)cc3)cc21.c1ccc(N(c2ccc(-c3ccc4c(c3)Oc3ccccc3N4c3ccccc3)cc2)c2ccc3c4ccccc4c4ccccc4c3c2)cc1.c1ccc(N(c2ccc(-c3ccc4c(c3)Oc3ccccc3N4c3ccccc3)cc2)c2ccc3oc4ccccc4c3c2)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4ccc(N(c5ccccc5)c5cc6ccccc6c6ccccc56)cc4)ccc32)cc1
InChIInChI=1S/C48H32N2O.C45H34N2O.C44H30N2O.C42H28N2O2/c1-3-13-35(14-4-1)49(38-28-29-43-41-19-8-7-17-39(41)40-18-9-10-20-42(40)44(43)32-38)37-26-23-33(24-27-37)34-25-30-46-48(31-34)51-47-22-12-11-21-45(47)50(46)36-15-5-2-6-16-36;1-45(2)39-18-10-9-17-37(39)38-27-26-36(30-40(38)45)46(33-13-5-3-6-14-33)35-24-21-31(22-25-35)32-23-28-42-44(29-32)48-43-20-12-11-19-41(43)47(42)34-15-7-4-8-16-34;1-3-14-34(15-4-1)45(42-29-33-13-7-8-18-37(33)38-19-9-10-20-39(38)42)36-26-23-31(24-27-36)32-25-28-41-44(30-32)47-43-22-12-11-21-40(43)46(41)35-16-5-2-6-17-35;1-3-11-31(12-4-1)43(34-24-26-40-36(28-34)35-15-7-9-17-39(35)45-40)33-22-19-29(20-23-33)30-21-25-38-42(27-30)46-41-18-10-8-16-37(41)44(38)32-13-5-2-6-14-32/h1-32H;3-30H,1-2H3;1-30H;1-28H
InChIKeyHDRQOQQFCQQZBV-UHFFFAOYSA-N
MW2467.01 g/mol
LogP51.57
Rot. Bonds20

About 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine

9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine (PubChem CID 158448567) has the molecular formula C179H124N8O5 and a molecular weight of 2467.01 g/mol. Its IUPAC name is 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine
PubChem CID158448567
Molecular FormulaC179H124N8O5
Molecular Weight2467.01 g/mol
Exact Mass2464.97
IUPAC Name9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)Oc4ccccc4N5c4ccccc4)cc3)cc21.c1ccc(N(c2ccc(-c3ccc4c(c3)Oc3ccccc3N4c3ccccc3)cc2)c2ccc3c4ccccc4c4ccccc4c3c2)cc1.c1ccc(N(c2ccc(-c3ccc4c(c3)Oc3ccccc3N4c3ccccc3)cc2)c2ccc3oc4ccccc4c3c2)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4ccc(N(c5ccccc5)c5cc6ccccc6c6ccccc56)cc4)ccc32)cc1
InChIInChI=1S/C48H32N2O.C45H34N2O.C44H30N2O.C42H28N2O2/c1-3-13-35(14-4-1)49(38-28-29-43-41-19-8-7-17-39(41)40-18-9-10-20-42(40)44(43)32-38)37-26-23-33(24-27-37)34-25-30-46-48(31-34)51-47-22-12-11-21-45(47)50(46)36-15-5-2-6-16-36;1-45(2)39-18-10-9-17-37(39)38-27-26-36(30-40(38)45)46(33-13-5-3-6-14-33)35-24-21-31(22-25-35)32-23-28-42-44(29-32)48-43-20-12-11-19-41(43)47(42)34-15-7-4-8-16-34;1-3-14-34(15-4-1)45(42-29-33-13-7-8-18-37(33)38-19-9-10-20-39(38)42)36-26-23-31(24-27-36)32-25-28-41-44(30-32)47-43-22-12-11-21-40(43)46(41)35-16-5-2-6-17-35;1-3-11-31(12-4-1)43(34-24-26-40-36(28-34)35-15-7-9-17-39(35)45-40)33-22-19-29(20-23-33)30-21-25-38-42(27-30)46-41-18-10-8-16-37(41)44(38)32-13-5-2-6-14-32/h1-32H;3-30H,1-2H3;1-30H;1-28H
InChIKeyHDRQOQQFCQQZBV-UHFFFAOYSA-N
XLogP51.57
TPSA75.98 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds20
Heavy Atoms192
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002467.01
LogP ≤ 551.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

Analyze 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine with MolForge

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Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]phenanthren-9-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]triphenylen-2-amine;N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-3-amine
CID 161070443
2-N,2-N-di(dibenzofuran-3-yl)-9,9-dimethyl-7-N-phenanthren-9-yl-7-N-phenylfluorene-2,7-diamine;2-N,2-N-di(dibenzofuran-2-yl)-9,9-dimethyl-7-N-phenyl-7-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine;2-N,2-N-di(dibenzofuran-4-yl)-9,9-dimethyl-7-N-phenyl-7-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine
CID 158392246
N-(9,9-dimethyl-7-phenylfluoren-2-yl)-N-[4-[4-(8-phenyldibenzofuran-2-yl)phenyl]phenyl]phenanthren-9-amine
CID 164843697
N-(4-carbazol-9-ylphenyl)-10-dibenzofuran-3-yl-N-naphthalen-2-ylphenoxazin-3-amine;10-dibenzofuran-3-yl-N-(9,9-dimethylfluoren-2-yl)-N-(3-phenylphenyl)phenoxazin-3-amine;10-dibenzofuran-3-yl-N-naphthalen-2-yl-N-(9-phenylcarbazol-2-yl)phenoxazin-3-amine
CID 165037780
2-N,2-N-di(dibenzofuran-3-yl)-9,9-dimethyl-7-N-phenanthren-9-yl-7-N-phenylfluorene-2,7-diamine
CID 89295879
N-(4-dibenzofuran-3-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-phenylfluoren-2-amine;N-(4-dibenzofuran-3-ylphenyl)-N-(9,9-dimethyl-7-phenylfluoren-2-yl)fluoranthen-3-amine;N-(4-dibenzofuran-3-ylphenyl)-N-(9,9-dimethyl-7-phenylfluoren-2-yl)phenanthren-9-amine
CID 158564276
N-[4-[4-(N-dibenzofuran-2-ylanilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine;2-N-dibenzofuran-2-yl-9,9-dimethyl-2-N,7-N-diphenyl-7-N-(9-phenylcarbazol-3-yl)fluorene-2,7-diamine;N-[4-[4-[4-[dibenzofuran-3-yl(phenanthren-9-yl)amino]phenyl]phenyl]phenyl]-N-phenanthren-9-yldibenzofuran-3-amine;N-[4-[4-[4-[dibenzofuran-4-yl(phenanthren-9-yl)amino]phenyl]phenyl]phenyl]-N-phenanthren-9-yldibenzofuran-4-amine
CID 158078970
N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 157179912
7-dibenzofuran-2-yl-9,9-dimethyl-N-phenanthren-3-yl-N-phenyl-10-(4-phenylphenyl)acridin-2-amine
CID 118122889
6-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-10-yl)-N,N-bis(4-phenylphenyl)naphthalen-2-amine;4-N-[4-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-10-yl)phenyl]-4-N-(9,9-dimethylfluoren-2-yl)-1-N,1-N-diphenylbenzene-1,4-diamine;N-[4-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-10-yl)phenyl]-N-(9,9-dimethylfluoren-2-yl)phenanthren-2-amine;4-N-[3-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-10-yl)phenyl]-1-N,1-N-diphenyl-4-N-(4-phenylphenyl)benzene-1,4-diamine;N-[4-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-10-yl)phenyl]-N-(4-phenylphenyl)phenanthren-9-amine;N-[4-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-10-yl)phenyl]-N-phenyl-4-(4-phenylphenyl)aniline
CID 161223475
N-[4-[4-(2-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)anilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(2-dibenzofuran-2-yl-N-phenanthren-9-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzofuran-2-ylphenyl)phenanthren-9-amine;N-(2-dibenzofuran-2-ylphenyl)-4-[4-[N-(2-dibenzofuran-2-ylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 161051331
6-N,18-N-bis(9,9-dimethylfluoren-2-yl)-6-N,18-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine;6-N,18-N-di(dibenzofuran-4-yl)-6-N,18-N-bis(2-methylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine;6-N,18-N-di(dibenzofuran-2-yl)-6-N,18-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine;6-N,18-N-di(dibenzofuran-4-yl)-6-N,18-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine;6-N,18-N-di(phenanthren-9-yl)-6-N,18-N-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene-6,18-diamine
CID 159858107

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine?
The IUPAC name of 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine (CID 158448567) is 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine.
What is the SMILES notation for 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine?
The canonical SMILES for 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)Oc4ccccc4N5c4ccccc4)cc3)cc21.c1ccc(N(c2ccc(-c3ccc4c(c3)Oc3ccccc3N4c3ccccc3)cc2)c2ccc3c4ccccc4c4ccccc4c3c2)cc1.c1ccc(N(c2ccc(-c3ccc4c(c3)Oc3ccccc3N4c3ccccc3)cc2)c2ccc3oc4ccccc4c3c2)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4ccc(N(c5ccccc5)c5cc6ccccc6c6ccccc56)cc4)ccc32)cc1.
What is the InChIKey of 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine?
The InChIKey is HDRQOQQFCQQZBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2O.C45H34N2O.C44H30N2O.C42H28N2O2/c1-3-13-35(14-4-1)49(38-28-29-43-41-19-8-7-17-39(41)40-18-9-10-20-42(40)44(43)32-38)37-26-23-33(24-27-37)34-25-30-46-48(31-34)51-47-22-12-11-21-45(47)50(46)36-15-5-2-6-16-36;1-45(2)39-18-10-9-17-37(39)38-27-26-36(30-40(38)45)46(33-13-5-3-6-14-33)35-24-21-31(22-25-35)32-23-28-42-44(29-32)48-43-20-12-11-19-41(43)47(42)34-15-7-4-8-16-34;1-3-14-34(15-4-1)45(42-29-33-13-7-8-18-37(33)38-19-9-10-20-39(38)42)36-26-23-31(24-27-36)32-25-28-41-44(30-32)47-43-22-12-11-21-40(43)46(41)35-16-5-2-6-17-35;1-3-11-31(12-4-1)43(34-24-26-40-36(28-34)35-15-7-9-17-39(35)45-40)33-22-19-29(20-23-33)30-21-25-38-42(27-30)46-41-18-10-8-16-37(41)44(38)32-13-5-2-6-14-32/h1-32H;3-30H,1-2H3;1-30H;1-28H.
What are the key properties of 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine?
9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine has a molecular weight of 2467.01 g/mol, XLogP of 51.57, 20 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]fluoren-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]dibenzofuran-2-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthren-9-amine;N-phenyl-N-[4-(10-phenylphenoxazin-3-yl)phenyl]triphenylen-2-amine is sourced from PubChem (CID 158448567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).