N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine

C138H108N4 — CID 159608670

IUPACN-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine
SMILESCC1(C)c2ccccc2-c2c1cc(N(c1ccc(-c3ccc(N(c4cccc(-c5ccccc5)c4)c4cc5c(c6ccccc46)-c4ccccc4C5(C)C)cc3)cc1)c1cccc(-c3ccccc3)c1)c1ccccc21.Cc1ccc(N(c2ccc(-c3ccc(N(c4ccc(C)cc4)c4cc5c(c6ccccc46)-c4ccccc4C5(C)C)cc3)cc2)c2cc3c(c4ccccc24)-c2ccccc2C3(C)C)cc1
InChIInChI=1S/C74H56N2.C64H52N2/c1-73(2)65-35-17-15-33-63(65)71-61-31-13-11-29-59(61)69(47-67(71)73)75(57-27-19-25-53(45-57)49-21-7-5-8-22-49)55-41-37-51(38-42-55)52-39-43-56(44-40-52)76(58-28-20-26-54(46-58)50-23-9-6-10-24-50)70-48-68-72(62-32-14-12-30-60(62)70)64-34-16-18-36-66(64)74(68,3)4;1-41-23-31-45(32-24-41)65(59-39-57-61(51-17-9-7-15-49(51)59)53-19-11-13-21-55(53)63(57,3)4)47-35-27-43(28-36-47)44-29-37-48(38-30-44)66(46-33-25-42(2)26-34-46)60-40-58-62(52-18-10-8-16-50(52)60)54-20-12-14-22-56(54)64(58,5)6/h5-48H,1-4H3;7-40H,1-6H3
InChIKeyMMKANHNJUMEDDG-UHFFFAOYSA-N
MW1822.41 g/mol
LogP38.38
Rot. Bonds16

About N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine

N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine (PubChem CID 159608670) has the molecular formula C138H108N4 and a molecular weight of 1822.41 g/mol. Its IUPAC name is N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine.

Molecular Properties

Compound NameN-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine
PubChem CID159608670
Molecular FormulaC138H108N4
Molecular Weight1822.41 g/mol
Exact Mass1820.86
IUPAC NameN-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine
SMILESCC1(C)c2ccccc2-c2c1cc(N(c1ccc(-c3ccc(N(c4cccc(-c5ccccc5)c4)c4cc5c(c6ccccc46)-c4ccccc4C5(C)C)cc3)cc1)c1cccc(-c3ccccc3)c1)c1ccccc21.Cc1ccc(N(c2ccc(-c3ccc(N(c4ccc(C)cc4)c4cc5c(c6ccccc46)-c4ccccc4C5(C)C)cc3)cc2)c2cc3c(c4ccccc24)-c2ccccc2C3(C)C)cc1
InChIInChI=1S/C74H56N2.C64H52N2/c1-73(2)65-35-17-15-33-63(65)71-61-31-13-11-29-59(61)69(47-67(71)73)75(57-27-19-25-53(45-57)49-21-7-5-8-22-49)55-41-37-51(38-42-55)52-39-43-56(44-40-52)76(58-28-20-26-54(46-58)50-23-9-6-10-24-50)70-48-68-72(62-32-14-12-30-60(62)70)64-34-16-18-36-66(64)74(68,3)4;1-41-23-31-45(32-24-41)65(59-39-57-61(51-17-9-7-15-49(51)59)53-19-11-13-21-55(53)63(57,3)4)47-35-27-43(28-36-47)44-29-37-48(38-30-44)66(46-33-25-42(2)26-34-46)60-40-58-62(52-18-10-8-16-50(52)60)54-20-12-14-22-56(54)64(58,5)6/h5-48H,1-4H3;7-40H,1-6H3
InChIKeyMMKANHNJUMEDDG-UHFFFAOYSA-N
XLogP38.38
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms142
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001822.41
LogP ≤ 538.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine
CID 162712377
7,7-dimethyl-5-N,5-N,9-N,9-N-tetrakis(4-phenylphenyl)benzo[c]fluorene-5,9-diamine
CID 162712053
N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-methylphenyl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-amine
CID 145144997
7,7-dimethyl-N-phenanthren-2-yl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]benzo[c]fluoren-5-amine
CID 169285163
9-N,9-N,19-N,19-N-tetrakis[4-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-12,12,22,22-tetramethylhexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16(21),17,19,23-undecaene-9,19-diamine
CID 155323973
12,12-dimethyl-N,N,15-tris(4-phenylphenyl)pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-amine
CID 118428464
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 169019716
7,7-dimethyl-5-N,9-N-bis(6-methyl-3-pyridinyl)-5-N,9-N-bis(4-phenylphenyl)benzo[c]fluorene-5,9-diamine
CID 139397270
N-(9,9-dimethylfluoren-3-yl)-7,7-dimethyl-N-(4-methylphenyl)-5-phenylbenzo[g]fluoren-8-amine
CID 164829480
3-(9,9-dimethylfluoren-4-yl)-N-[3-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 154972984
5-N,9-N-bis[3-(3,6-diphenylcarbazol-9-yl)phenyl]-7,7-dimethyl-5-N,9-N-bis(4-phenylphenyl)benzo[c]fluorene-5,9-diamine
CID 118038912
N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-3-(4-phenylphenyl)aniline
CID 169019629

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine?
The IUPAC name of N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine (CID 159608670) is N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine.
What is the SMILES notation for N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine?
The canonical SMILES for N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine is CC1(C)c2ccccc2-c2c1cc(N(c1ccc(-c3ccc(N(c4cccc(-c5ccccc5)c4)c4cc5c(c6ccccc46)-c4ccccc4C5(C)C)cc3)cc1)c1cccc(-c3ccccc3)c1)c1ccccc21.Cc1ccc(N(c2ccc(-c3ccc(N(c4ccc(C)cc4)c4cc5c(c6ccccc46)-c4ccccc4C5(C)C)cc3)cc2)c2cc3c(c4ccccc24)-c2ccccc2C3(C)C)cc1.
What is the InChIKey of N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine?
The InChIKey is MMKANHNJUMEDDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H56N2.C64H52N2/c1-73(2)65-35-17-15-33-63(65)71-61-31-13-11-29-59(61)69(47-67(71)73)75(57-27-19-25-53(45-57)49-21-7-5-8-22-49)55-41-37-51(38-42-55)52-39-43-56(44-40-52)76(58-28-20-26-54(46-58)50-23-9-6-10-24-50)70-48-68-72(62-32-14-12-30-60(62)70)64-34-16-18-36-66(64)74(68,3)4;1-41-23-31-45(32-24-41)65(59-39-57-61(51-17-9-7-15-49(51)59)53-19-11-13-21-55(53)63(57,3)4)47-35-27-43(28-36-47)44-29-37-48(38-30-44)66(46-33-25-42(2)26-34-46)60-40-58-62(52-18-10-8-16-50(52)60)54-20-12-14-22-56(54)64(58,5)6/h5-48H,1-4H3;7-40H,1-6H3.
What are the key properties of N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine?
N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine has a molecular weight of 1822.41 g/mol, XLogP of 38.38, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine is sourced from PubChem (CID 159608670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).