7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline

C163H118N6 — CID 157400056

IUPAC7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline
SMILESCC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7ccccc67)cc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C62H44N2.C51H38N2.C50H36N2/c1-3-13-45(14-4-1)46-25-35-54(36-26-46)63(53-19-5-2-6-20-53)55-37-27-47(28-38-55)48-29-39-56(40-30-48)64(57-41-31-51(32-42-57)61-23-11-17-49-15-7-9-21-59(49)61)58-43-33-52(34-44-58)62-24-12-18-50-16-8-10-22-60(50)62;1-51(2)47-33-41(29-31-43(47)44-32-30-42(34-48(44)51)53-49-19-11-9-17-45(49)46-18-10-12-20-50(46)53)52(39-25-21-37(22-26-39)35-13-5-3-6-14-35)40-27-23-38(24-28-40)36-15-7-4-8-16-36;1-3-11-37(12-4-1)41-19-25-45(26-20-41)51(46-27-21-42(22-28-46)38-13-5-2-6-14-38)47-31-33-48(34-32-47)52(49-29-23-39-15-7-9-17-43(39)35-49)50-30-24-40-16-8-10-18-44(40)36-50/h1-44H;3-34H,1-2H3;1-36H
InChIKeyBNAVNJXPLHZHDC-UHFFFAOYSA-N
MW2160.78 g/mol
LogP45.76
Rot. Bonds24

About 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline

7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline (PubChem CID 157400056) has the molecular formula C163H118N6 and a molecular weight of 2160.78 g/mol. Its IUPAC name is 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline.

Molecular Properties

Compound Name7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline
PubChem CID157400056
Molecular FormulaC163H118N6
Molecular Weight2160.78 g/mol
Exact Mass2158.94
IUPAC Name7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline
SMILESCC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7ccccc67)cc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C62H44N2.C51H38N2.C50H36N2/c1-3-13-45(14-4-1)46-25-35-54(36-26-46)63(53-19-5-2-6-20-53)55-37-27-47(28-38-55)48-29-39-56(40-30-48)64(57-41-31-51(32-42-57)61-23-11-17-49-15-7-9-21-59(49)61)58-43-33-52(34-44-58)62-24-12-18-50-16-8-10-22-60(50)62;1-51(2)47-33-41(29-31-43(47)44-32-30-42(34-48(44)51)53-49-19-11-9-17-45(49)46-18-10-12-20-50(46)53)52(39-25-21-37(22-26-39)35-13-5-3-6-14-35)40-27-23-38(24-28-40)36-15-7-4-8-16-36;1-3-11-37(12-4-1)41-19-25-45(26-20-41)51(46-27-21-42(22-28-46)38-13-5-2-6-14-38)47-31-33-48(34-32-47)52(49-29-23-39-15-7-9-17-43(39)35-49)50-30-24-40-16-8-10-18-44(40)36-50/h1-44H;3-34H,1-2H3;1-36H
InChIKeyBNAVNJXPLHZHDC-UHFFFAOYSA-N
XLogP45.76
TPSA21.13 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds24
Heavy Atoms169
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002160.78
LogP ≤ 545.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline?
The IUPAC name of 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline (CID 157400056) is 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline.
What is the SMILES notation for 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline?
The canonical SMILES for 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline is CC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7ccccc67)cc5)cc4)cc3)cc2)cc1.
What is the InChIKey of 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline?
The InChIKey is BNAVNJXPLHZHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H44N2.C51H38N2.C50H36N2/c1-3-13-45(14-4-1)46-25-35-54(36-26-46)63(53-19-5-2-6-20-53)55-37-27-47(28-38-55)48-29-39-56(40-30-48)64(57-41-31-51(32-42-57)61-23-11-17-49-15-7-9-21-59(49)61)58-43-33-52(34-44-58)62-24-12-18-50-16-8-10-22-60(50)62;1-51(2)47-33-41(29-31-43(47)44-32-30-42(34-48(44)51)53-49-19-11-9-17-45(49)46-18-10-12-20-50(46)53)52(39-25-21-37(22-26-39)35-13-5-3-6-14-35)40-27-23-38(24-28-40)36-15-7-4-8-16-36;1-3-11-37(12-4-1)41-19-25-45(26-20-41)51(46-27-21-42(22-28-46)38-13-5-2-6-14-38)47-31-33-48(34-32-47)52(49-29-23-39-15-7-9-17-43(39)35-49)50-30-24-40-16-8-10-18-44(40)36-50/h1-44H;3-34H,1-2H3;1-36H.
What are the key properties of 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline?
7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline has a molecular weight of 2160.78 g/mol, XLogP of 45.76, 24 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;4-N,4-N-dinaphthalen-2-yl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;N-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,4-diphenylaniline is sourced from PubChem (CID 157400056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).