N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine

C142H116N4O4 — CID 159199644

IUPACN-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
SMILESC=Cc1ccc(COCc2ccc(-n3c4ccc(COCc5ccc(C=C)cc5)cc4c4cc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)ccc43)cc2)cc1.C=Cc1ccc(COCc2ccc(-n3c4ccccc4c4cc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc7c(c6)C(C)(C)c6cc(COCc8ccc(C=C)cc8)ccc6-7)cc5)ccc43)cc2)cc1
InChIInChI=1S/2C71H58N2O2/c1-5-49-16-20-51(21-17-49)45-74-47-53-24-32-61(33-25-53)73-69-40-26-54(48-75-46-52-22-18-50(6-2)19-23-52)42-65(69)66-43-58(31-41-70(66)73)57-29-36-60(37-30-57)72(59-34-27-56(28-35-59)55-12-8-7-9-13-55)62-38-39-64-63-14-10-11-15-67(63)71(3,4)68(64)44-62;1-5-49-16-20-51(21-17-49)45-74-47-53-24-32-61(33-25-53)73-69-15-11-10-14-65(69)66-43-58(31-41-70(66)73)57-29-36-60(37-30-57)72(59-34-27-56(28-35-59)55-12-8-7-9-13-55)62-38-40-64-63-39-26-54(42-67(63)71(3,4)68(64)44-62)48-75-46-52-22-18-50(6-2)19-23-52/h2*5-44H,1-2,45-48H2,3-4H3
InChIKeyKPCVLGAHKNRRDQ-UHFFFAOYSA-N
MW1942.51 g/mol
LogP37.23
Rot. Bonds32

About N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine

N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 159199644) has the molecular formula C142H116N4O4 and a molecular weight of 1942.51 g/mol. Its IUPAC name is N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound NameN-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
PubChem CID159199644
Molecular FormulaC142H116N4O4
Molecular Weight1942.51 g/mol
Exact Mass1940.90
IUPAC NameN-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
SMILESC=Cc1ccc(COCc2ccc(-n3c4ccc(COCc5ccc(C=C)cc5)cc4c4cc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)ccc43)cc2)cc1.C=Cc1ccc(COCc2ccc(-n3c4ccccc4c4cc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc7c(c6)C(C)(C)c6cc(COCc8ccc(C=C)cc8)ccc6-7)cc5)ccc43)cc2)cc1
InChIInChI=1S/2C71H58N2O2/c1-5-49-16-20-51(21-17-49)45-74-47-53-24-32-61(33-25-53)73-69-40-26-54(48-75-46-52-22-18-50(6-2)19-23-52)42-65(69)66-43-58(31-41-70(66)73)57-29-36-60(37-30-57)72(59-34-27-56(28-35-59)55-12-8-7-9-13-55)62-38-39-64-63-14-10-11-15-67(63)71(3,4)68(64)44-62;1-5-49-16-20-51(21-17-49)45-74-47-53-24-32-61(33-25-53)73-69-15-11-10-14-65(69)66-43-58(31-41-70(66)73)57-29-36-60(37-30-57)72(59-34-27-56(28-35-59)55-12-8-7-9-13-55)62-38-40-64-63-39-26-54(42-67(63)71(3,4)68(64)44-62)48-75-46-52-22-18-50(6-2)19-23-52/h2*5-44H,1-2,45-48H2,3-4H3
InChIKeyKPCVLGAHKNRRDQ-UHFFFAOYSA-N
XLogP37.23
TPSA53.26 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds32
Heavy Atoms150
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001942.51
LogP ≤ 537.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine (CID 159199644) is N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine is C=Cc1ccc(COCc2ccc(-n3c4ccc(COCc5ccc(C=C)cc5)cc4c4cc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)ccc43)cc2)cc1.C=Cc1ccc(COCc2ccc(-n3c4ccccc4c4cc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc7c(c6)C(C)(C)c6cc(COCc8ccc(C=C)cc8)ccc6-7)cc5)ccc43)cc2)cc1.
What is the InChIKey of N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is KPCVLGAHKNRRDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C71H58N2O2/c1-5-49-16-20-51(21-17-49)45-74-47-53-24-32-61(33-25-53)73-69-40-26-54(48-75-46-52-22-18-50(6-2)19-23-52)42-65(69)66-43-58(31-41-70(66)73)57-29-36-60(37-30-57)72(59-34-27-56(28-35-59)55-12-8-7-9-13-55)62-38-39-64-63-14-10-11-15-67(63)71(3,4)68(64)44-62;1-5-49-16-20-51(21-17-49)45-74-47-53-24-32-61(33-25-53)73-69-15-11-10-14-65(69)66-43-58(31-41-70(66)73)57-29-36-60(37-30-57)72(59-34-27-56(28-35-59)55-12-8-7-9-13-55)62-38-40-64-63-39-26-54(42-67(63)71(3,4)68(64)44-62)48-75-46-52-22-18-50(6-2)19-23-52/h2*5-44H,1-2,45-48H2,3-4H3.
What are the key properties of N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine?
N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 1942.51 g/mol, XLogP of 37.23, 32 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 159199644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).