9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine

C48H35N — CID 169020120

IUPAC9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine
SMILESCC1(c2ccccc2)c2ccccc2-c2c(N(c3ccc4ccccc4c3)c3ccccc3-c3ccc(-c4ccccc4)cc3)cccc21
InChIInChI=1S/C48H35N/c1-48(39-19-6-3-7-20-39)43-23-12-10-22-42(43)47-44(48)24-14-26-46(47)49(40-32-31-35-17-8-9-18-38(35)33-40)45-25-13-11-21-41(45)37-29-27-36(28-30-37)34-15-4-2-5-16-34/h2-33H,1H3
InChIKeySPCJDTJVERXDOF-UHFFFAOYSA-N
MW625.82 g/mol
LogP12.98
Rot. Bonds6

About 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine

9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine (PubChem CID 169020120) has the molecular formula C48H35N and a molecular weight of 625.82 g/mol. Its IUPAC name is 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine.

Molecular Properties

Compound Name9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine
PubChem CID169020120
Molecular FormulaC48H35N
Molecular Weight625.82 g/mol
Exact Mass625.28
IUPAC Name9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine
SMILESCC1(c2ccccc2)c2ccccc2-c2c(N(c3ccc4ccccc4c3)c3ccccc3-c3ccc(-c4ccccc4)cc3)cccc21
InChIInChI=1S/C48H35N/c1-48(39-19-6-3-7-20-39)43-23-12-10-22-42(43)47-44(48)24-14-26-46(47)49(40-32-31-35-17-8-9-18-38(35)33-40)45-25-13-11-21-41(45)37-29-27-36(28-30-37)34-15-4-2-5-16-34/h2-33H,1H3
InChIKeySPCJDTJVERXDOF-UHFFFAOYSA-N
XLogP12.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500625.82
LogP ≤ 512.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-methyl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9-phenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169020008
9-methyl-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-9-phenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169020477
9-methyl-N-(4-naphthalen-2-ylphenyl)-9-phenyl-N-[4-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169019936
9-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-9-phenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 169020096
2-(9-methyl-9-phenylfluoren-4-yl)-N-(4-naphthalen-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 169019481
9-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9-phenylfluoren-4-amine
CID 169019683
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-N-[2-(9-methyl-9-phenylfluoren-3-yl)phenyl]naphthalen-2-amine
CID 170136631
N-[3-(9-methyl-9-phenylfluoren-4-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-2-amine
CID 169020514
N-[4-(9,10-diphenylphenanthren-2-yl)phenyl]-9-methyl-9-phenyl-N-(2-phenylphenyl)fluoren-4-amine
CID 169063045
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]naphthalen-2-amine
CID 170135293
N-(3,5-diphenylphenyl)-9-methyl-9-phenyl-N-(4-phenylphenyl)fluoren-4-amine
CID 118188510
N-[4-(9-methyl-9-phenylfluoren-4-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)-2-(4-phenylphenyl)aniline
CID 169020125

Frequently Asked Questions

What is the IUPAC name of 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine?
The IUPAC name of 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine (CID 169020120) is 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine.
What is the SMILES notation for 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine?
The canonical SMILES for 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine is CC1(c2ccccc2)c2ccccc2-c2c(N(c3ccc4ccccc4c3)c3ccccc3-c3ccc(-c4ccccc4)cc3)cccc21.
What is the InChIKey of 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine?
The InChIKey is SPCJDTJVERXDOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H35N/c1-48(39-19-6-3-7-20-39)43-23-12-10-22-42(43)47-44(48)24-14-26-46(47)49(40-32-31-35-17-8-9-18-38(35)33-40)45-25-13-11-21-41(45)37-29-27-36(28-30-37)34-15-4-2-5-16-34/h2-33H,1H3.
What are the key properties of 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine?
9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine has a molecular weight of 625.82 g/mol, XLogP of 12.98, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-N-naphthalen-2-yl-9-phenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-4-amine is sourced from PubChem (CID 169020120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).