7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine

C195H139N11 — CID 161334482

IUPAC7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESCC1(C)c2cc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5ccccc5)c4)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)n2)cc1
InChIInChI=1S/C63H46N2.3C44H31N3/c1-63(2)59-41-53(35-37-55(59)56-38-36-54(42-60(56)63)65-61-25-11-9-23-57(61)58-24-10-12-26-62(58)65)64(51-31-27-45(28-32-51)49-21-13-19-47(39-49)43-15-5-3-6-16-43)52-33-29-46(30-34-52)50-22-14-20-48(40-50)44-17-7-4-8-18-44;2*1-4-14-35(15-5-1)41-31-42(46-44(45-41)37-16-6-2-7-17-37)36-25-23-32(24-26-36)33-27-29-39(30-28-33)47(38-19-8-3-9-20-38)43-22-12-18-34-13-10-11-21-40(34)43;1-4-14-35(15-5-1)41-31-42(36-16-6-2-7-17-36)46-44(45-41)37-25-23-32(24-26-37)33-27-29-39(30-28-33)47(38-19-8-3-9-20-38)43-22-12-18-34-13-10-11-21-40(34)43/h3-42H,1-2H3;3*1-31H
InChIKeyVLVQGGLKFDIFBT-UHFFFAOYSA-N
MW2636.33 g/mol
LogP52.53
Rot. Bonds29

About 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine

7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine (PubChem CID 161334482) has the molecular formula C195H139N11 and a molecular weight of 2636.33 g/mol. Its IUPAC name is 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine.

Molecular Properties

Compound Name7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
PubChem CID161334482
Molecular FormulaC195H139N11
Molecular Weight2636.33 g/mol
Exact Mass2634.12
IUPAC Name7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
SMILESCC1(C)c2cc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5ccccc5)c4)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)n2)cc1
InChIInChI=1S/C63H46N2.3C44H31N3/c1-63(2)59-41-53(35-37-55(59)56-38-36-54(42-60(56)63)65-61-25-11-9-23-57(61)58-24-10-12-26-62(58)65)64(51-31-27-45(28-32-51)49-21-13-19-47(39-49)43-15-5-3-6-16-43)52-33-29-46(30-34-52)50-22-14-20-48(40-50)44-17-7-4-8-18-44;2*1-4-14-35(15-5-1)41-31-42(46-44(45-41)37-16-6-2-7-17-37)36-25-23-32(24-26-36)33-27-29-39(30-28-33)47(38-19-8-3-9-20-38)43-22-12-18-34-13-10-11-21-40(34)43;1-4-14-35(15-5-1)41-31-42(36-16-6-2-7-17-36)46-44(45-41)37-25-23-32(24-26-37)33-27-29-39(30-28-33)47(38-19-8-3-9-20-38)43-22-12-18-34-13-10-11-21-40(34)43/h3-42H,1-2H3;3*1-31H
InChIKeyVLVQGGLKFDIFBT-UHFFFAOYSA-N
XLogP52.53
TPSA95.23 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds29
Heavy Atoms206
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002636.33
LogP ≤ 552.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine 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-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The IUPAC name of 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine (CID 161334482) is 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine.
What is the SMILES notation for 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The canonical SMILES for 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine is CC1(C)c2cc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5ccccc5)c4)cc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)cc3)n2)cc1.
What is the InChIKey of 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
The InChIKey is VLVQGGLKFDIFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H46N2.3C44H31N3/c1-63(2)59-41-53(35-37-55(59)56-38-36-54(42-60(56)63)65-61-25-11-9-23-57(61)58-24-10-12-26-62(58)65)64(51-31-27-45(28-32-51)49-21-13-19-47(39-49)43-15-5-3-6-16-43)52-33-29-46(30-34-52)50-22-14-20-48(40-50)44-17-7-4-8-18-44;2*1-4-14-35(15-5-1)41-31-42(46-44(45-41)37-16-6-2-7-17-37)36-25-23-32(24-26-36)33-27-29-39(30-28-33)47(38-19-8-3-9-20-38)43-22-12-18-34-13-10-11-21-40(34)43;1-4-14-35(15-5-1)41-31-42(36-16-6-2-7-17-36)46-44(45-41)37-25-23-32(24-26-37)33-27-29-39(30-28-33)47(38-19-8-3-9-20-38)43-22-12-18-34-13-10-11-21-40(34)43/h3-42H,1-2H3;3*1-31H.
What are the key properties of 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine?
7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine has a molecular weight of 2636.33 g/mol, XLogP of 52.53, 29 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 7-carbazol-9-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;bis(N-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine);N-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine is sourced from PubChem (CID 161334482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).