N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine

C74H66N2O2 — CID 175472808

IUPACN-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine
SMILESCOc1ccc(N(c2ccc(C3(C)c4cc(N(c5ccc(OC)c(-c6ccccc6)c5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)ccc4C(C)C3C)cc2)c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1-c1ccccc1
InChIInChI=1S/C74H66N2O2/c1-47-48(2)74(7,51-28-30-52(31-29-51)75(53-35-40-70(77-8)63(42-53)49-20-12-10-13-21-49)55-33-38-61-59-24-16-18-26-65(59)72(3,4)67(61)44-55)69-46-57(32-37-58(47)69)76(54-36-41-71(78-9)64(43-54)50-22-14-11-15-23-50)56-34-39-62-60-25-17-19-27-66(60)73(5,6)68(62)45-56/h10-48H,1-9H3
InChIKeyDGMYNAFXTRJURY-UHFFFAOYSA-N
MW1015.35 g/mol
LogP19.65
Rot. Bonds11

About N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine

N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine (PubChem CID 175472808) has the molecular formula C74H66N2O2 and a molecular weight of 1015.35 g/mol. Its IUPAC name is N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine.

Molecular Properties

Compound NameN-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine
PubChem CID175472808
Molecular FormulaC74H66N2O2
Molecular Weight1015.35 g/mol
Exact Mass1014.51
IUPAC NameN-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine
SMILESCOc1ccc(N(c2ccc(C3(C)c4cc(N(c5ccc(OC)c(-c6ccccc6)c5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)ccc4C(C)C3C)cc2)c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1-c1ccccc1
InChIInChI=1S/C74H66N2O2/c1-47-48(2)74(7,51-28-30-52(31-29-51)75(53-35-40-70(77-8)63(42-53)49-20-12-10-13-21-49)55-33-38-61-59-24-16-18-26-65(59)72(3,4)67(61)44-55)69-46-57(32-37-58(47)69)76(54-36-41-71(78-9)64(43-54)50-22-14-11-15-23-50)56-34-39-62-60-25-17-19-27-66(60)73(5,6)68(62)45-56/h10-48H,1-9H3
InChIKeyDGMYNAFXTRJURY-UHFFFAOYSA-N
XLogP19.65
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001015.35
LogP ≤ 519.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine with MolForge

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Related Compounds

9,9-bis(4-methoxy-3-phenylphenyl)-N,N-diphenylfluoren-2-amine
CID 139762357
1-N,1-N-bis[4-(N-(9,9-dimethylfluoren-2-yl)-4-methoxyanilino)phenyl]-4-N-(4-methoxyphenyl)-4-N-(9-methyl-9H-fluoren-3-yl)benzene-1,4-diamine
CID 123541710
N-[3,4-bis(4-phenylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 134198401
N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)-2-phenylphenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 137389722
4-N,4-N-bis(9,9-dimethylfluoren-2-yl)-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine
CID 23561786
N,N-bis[4-(2,6-diphenylphenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 168771647
N-[4-[2,5-diphenyl-4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 176611399
N-[4-[2-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 121298487
N-(3,4-diphenylphenyl)-9,9-dimethyl-7-(9-methylfluoren-9-yl)-N-phenylfluoren-2-amine
CID 140919895
N,N-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-5-phenylfluoren-3-amine
CID 169039545
N-[4-[3-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 169230595
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 118146254

Frequently Asked Questions

What is the IUPAC name of N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine?
The IUPAC name of N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine (CID 175472808) is N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine.
What is the SMILES notation for N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine?
The canonical SMILES for N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine is COc1ccc(N(c2ccc(C3(C)c4cc(N(c5ccc(OC)c(-c6ccccc6)c5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)ccc4C(C)C3C)cc2)c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1-c1ccccc1.
What is the InChIKey of N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine?
The InChIKey is DGMYNAFXTRJURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H66N2O2/c1-47-48(2)74(7,51-28-30-52(31-29-51)75(53-35-40-70(77-8)63(42-53)49-20-12-10-13-21-49)55-33-38-61-59-24-16-18-26-65(59)72(3,4)67(61)44-55)69-46-57(32-37-58(47)69)76(54-36-41-71(78-9)64(43-54)50-22-14-11-15-23-50)56-34-39-62-60-25-17-19-27-66(60)73(5,6)68(62)45-56/h10-48H,1-9H3.
What are the key properties of N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine?
N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine has a molecular weight of 1015.35 g/mol, XLogP of 19.65, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[6-(N-(9,9-dimethylfluoren-2-yl)-4-methoxy-3-phenylanilino)-1,2,3-trimethyl-2,3-dihydroinden-1-yl]phenyl]-N-(4-methoxy-3-phenylphenyl)-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 175472808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).