9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine

C145H109N3 — CID 157128251

IUPAC9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3-c3ccccc3C4(C)c3ccccc3)cc21.Cc1ccc(C2(C)c3ccccc3-c3cccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)c32)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)-c3ccccc3C4(c3ccccc3)c3cccc4ccccc34)c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C53H37N.C47H37N.C45H35N/c1-4-17-38(18-5-1)39-31-33-43(34-32-39)54(52-30-15-13-26-46(52)41-19-6-2-7-20-41)44-35-36-51-48(37-44)47-27-12-14-28-50(47)53(51,42-23-8-3-9-24-42)49-29-16-22-40-21-10-11-25-45(40)49;1-46(2)40-21-12-10-19-37(40)38-30-29-36(31-43(38)46)48(35-27-25-33(26-28-35)32-15-6-4-7-16-32)44-24-14-23-42-45(44)39-20-11-13-22-41(39)47(42,3)34-17-8-5-9-18-34;1-32-20-26-37(27-21-32)45(2)42-18-10-9-16-40(42)41-17-11-19-43(44(41)45)46(38-28-22-35(23-29-38)33-12-5-3-6-13-33)39-30-24-36(25-31-39)34-14-7-4-8-15-34/h1-37H;4-31H,1-3H3;3-31H,1-2H3
InChIKeyAITHSHWIXAQPQY-UHFFFAOYSA-N
MW1893.49 g/mol
LogP38.60
Rot. Bonds18

About 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine

9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine (PubChem CID 157128251) has the molecular formula C145H109N3 and a molecular weight of 1893.49 g/mol. Its IUPAC name is 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine
PubChem CID157128251
Molecular FormulaC145H109N3
Molecular Weight1893.49 g/mol
Exact Mass1891.86
IUPAC Name9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3-c3ccccc3C4(C)c3ccccc3)cc21.Cc1ccc(C2(C)c3ccccc3-c3cccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)c32)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)-c3ccccc3C4(c3ccccc3)c3cccc4ccccc34)c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C53H37N.C47H37N.C45H35N/c1-4-17-38(18-5-1)39-31-33-43(34-32-39)54(52-30-15-13-26-46(52)41-19-6-2-7-20-41)44-35-36-51-48(37-44)47-27-12-14-28-50(47)53(51,42-23-8-3-9-24-42)49-29-16-22-40-21-10-11-25-45(40)49;1-46(2)40-21-12-10-19-37(40)38-30-29-36(31-43(38)46)48(35-27-25-33(26-28-35)32-15-6-4-7-16-32)44-24-14-23-42-45(44)39-20-11-13-22-41(39)47(42,3)34-17-8-5-9-18-34;1-32-20-26-37(27-21-32)45(2)42-18-10-9-16-40(42)41-17-11-19-43(44(41)45)46(38-28-22-35(23-29-38)33-12-5-3-6-13-33)39-30-24-36(25-31-39)34-14-7-4-8-15-34/h1-37H;4-31H,1-3H3;3-31H,1-2H3
InChIKeyAITHSHWIXAQPQY-UHFFFAOYSA-N
XLogP38.60
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms148
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001893.49
LogP ≤ 538.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine?
The IUPAC name of 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine (CID 157128251) is 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine.
What is the SMILES notation for 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine?
The canonical SMILES for 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3-c3ccccc3C4(C)c3ccccc3)cc21.Cc1ccc(C2(C)c3ccccc3-c3cccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)c32)cc1.c1ccc(-c2ccc(N(c3ccc4c(c3)-c3ccccc3C4(c3ccccc3)c3cccc4ccccc34)c3ccccc3-c3ccccc3)cc2)cc1.
What is the InChIKey of 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine?
The InChIKey is AITHSHWIXAQPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H37N.C47H37N.C45H35N/c1-4-17-38(18-5-1)39-31-33-43(34-32-39)54(52-30-15-13-26-46(52)41-19-6-2-7-20-41)44-35-36-51-48(37-44)47-27-12-14-28-50(47)53(51,42-23-8-3-9-24-42)49-29-16-22-40-21-10-11-25-45(40)49;1-46(2)40-21-12-10-19-37(40)38-30-29-36(31-43(38)46)48(35-27-25-33(26-28-35)32-15-6-4-7-16-32)44-24-14-23-42-45(44)39-20-11-13-22-41(39)47(42,3)34-17-8-5-9-18-34;1-32-20-26-37(27-21-32)45(2)42-18-10-9-16-40(42)41-17-11-19-43(44(41)45)46(38-28-22-35(23-29-38)33-12-5-3-6-13-33)39-30-24-36(25-31-39)34-14-7-4-8-15-34/h1-37H;4-31H,1-3H3;3-31H,1-2H3.
What are the key properties of 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine?
9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine has a molecular weight of 1893.49 g/mol, XLogP of 38.60, 18 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-(9-methyl-9-phenylfluoren-4-yl)-N-(4-phenylphenyl)fluoren-2-amine;9-methyl-9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)fluoren-1-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine is sourced from PubChem (CID 157128251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).