9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine

C232H172N8 — CID 157496502

IUPAC9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine
SMILESCC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3cccc4ccccc34)cc21
InChIInChI=1S/2C59H44N2.2C57H42N2/c1-59(2)55-39-49(60(47-24-7-4-8-25-47)57-28-14-20-43-18-9-11-26-51(43)57)34-36-53(55)54-37-35-50(40-56(54)59)61(58-29-15-21-44-19-10-12-27-52(44)58)48-32-30-42(31-33-48)46-23-13-22-45(38-46)41-16-5-3-6-17-41;1-59(2)55-39-49(60(47-21-7-4-8-22-47)57-25-13-19-45-17-9-11-23-51(45)57)35-37-53(55)54-38-36-50(40-56(54)59)61(58-26-14-20-46-18-10-12-24-52(46)58)48-33-31-44(32-34-48)43-29-27-42(28-30-43)41-15-5-3-6-16-41;1-57(2)53-37-45(58(43-21-4-3-5-22-43)55-27-13-19-40-16-7-10-24-49(40)55)33-35-51(53)52-36-34-46(38-54(52)57)59(56-28-14-20-41-17-8-11-25-50(41)56)44-31-29-42(30-32-44)48-26-12-18-39-15-6-9-23-47(39)48;1-57(2)53-37-47(58(45-20-4-3-5-21-45)55-24-12-18-41-15-8-10-22-49(41)55)32-34-51(53)52-35-33-48(38-54(52)57)59(56-25-13-19-42-16-9-11-23-50(42)56)46-30-28-40(29-31-46)44-27-26-39-14-6-7-17-43(39)36-44/h2*3-40H,1-2H3;2*3-38H,1-2H3
InChIKeyBXWZAHZMGASEHW-UHFFFAOYSA-N
MW3071.98 g/mol
LogP65.26
Rot. Bonds30

About 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine

9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine (PubChem CID 157496502) has the molecular formula C232H172N8 and a molecular weight of 3071.98 g/mol. Its IUPAC name is 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine.

Molecular Properties

Compound Name9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine
PubChem CID157496502
Molecular FormulaC232H172N8
Molecular Weight3071.98 g/mol
Exact Mass3069.37
IUPAC Name9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine
SMILESCC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3cccc4ccccc34)cc21
InChIInChI=1S/2C59H44N2.2C57H42N2/c1-59(2)55-39-49(60(47-24-7-4-8-25-47)57-28-14-20-43-18-9-11-26-51(43)57)34-36-53(55)54-37-35-50(40-56(54)59)61(58-29-15-21-44-19-10-12-27-52(44)58)48-32-30-42(31-33-48)46-23-13-22-45(38-46)41-16-5-3-6-17-41;1-59(2)55-39-49(60(47-21-7-4-8-22-47)57-25-13-19-45-17-9-11-23-51(45)57)35-37-53(55)54-38-36-50(40-56(54)59)61(58-26-14-20-46-18-10-12-24-52(46)58)48-33-31-44(32-34-48)43-29-27-42(28-30-43)41-15-5-3-6-16-41;1-57(2)53-37-45(58(43-21-4-3-5-22-43)55-27-13-19-40-16-7-10-24-49(40)55)33-35-51(53)52-36-34-46(38-54(52)57)59(56-28-14-20-41-17-8-11-25-50(41)56)44-31-29-42(30-32-44)48-26-12-18-39-15-6-9-23-47(39)48;1-57(2)53-37-47(58(45-20-4-3-5-21-45)55-24-12-18-41-15-8-10-22-49(41)55)32-34-51(53)52-35-33-48(38-54(52)57)59(56-25-13-19-42-16-9-11-23-50(42)56)46-30-28-40(29-31-46)44-27-26-39-14-6-7-17-43(39)36-44/h2*3-40H,1-2H3;2*3-38H,1-2H3
InChIKeyBXWZAHZMGASEHW-UHFFFAOYSA-N
XLogP65.26
TPSA25.92 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds30
Heavy Atoms240
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003071.98
LogP ≤ 565.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine?
The IUPAC name of 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine (CID 157496502) is 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine.
What is the SMILES notation for 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine?
The canonical SMILES for 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine is CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3cccc4ccccc34)cc21.CC1(C)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3cccc4ccccc34)cc21.
What is the InChIKey of 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine?
The InChIKey is BXWZAHZMGASEHW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C59H44N2.2C57H42N2/c1-59(2)55-39-49(60(47-24-7-4-8-25-47)57-28-14-20-43-18-9-11-26-51(43)57)34-36-53(55)54-37-35-50(40-56(54)59)61(58-29-15-21-44-19-10-12-27-52(44)58)48-32-30-42(31-33-48)46-23-13-22-45(38-46)41-16-5-3-6-17-41;1-59(2)55-39-49(60(47-21-7-4-8-22-47)57-25-13-19-45-17-9-11-23-51(45)57)35-37-53(55)54-38-36-50(40-56(54)59)61(58-26-14-20-46-18-10-12-24-52(46)58)48-33-31-44(32-34-48)43-29-27-42(28-30-43)41-15-5-3-6-16-41;1-57(2)53-37-45(58(43-21-4-3-5-22-43)55-27-13-19-40-16-7-10-24-49(40)55)33-35-51(53)52-36-34-46(38-54(52)57)59(56-28-14-20-41-17-8-11-25-50(41)56)44-31-29-42(30-32-44)48-26-12-18-39-15-6-9-23-47(39)48;1-57(2)53-37-47(58(45-20-4-3-5-21-45)55-24-12-18-41-15-8-10-22-49(41)55)32-34-51(53)52-35-33-48(38-54(52)57)59(56-25-13-19-42-16-9-11-23-50(42)56)46-30-28-40(29-31-46)44-27-26-39-14-6-7-17-43(39)36-44/h2*3-40H,1-2H3;2*3-38H,1-2H3.
What are the key properties of 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine?
9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine has a molecular weight of 3071.98 g/mol, XLogP of 65.26, 30 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-1-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N-(4-naphthalen-2-ylphenyl)-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(3-phenylphenyl)phenyl]fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-[4-(4-phenylphenyl)phenyl]fluorene-2,7-diamine is sourced from PubChem (CID 157496502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).