N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine

C53H41N — CID 170447280

IUPACN,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine
SMILESc1ccc(N(c2ccccc2)c2cc3c(cc2-c2ccc(-c4ccc5c(c4)CCCC5)cc2)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C53H41N/c1-5-19-43(20-6-1)53(44-21-7-2-8-22-44)50-28-16-15-27-47(50)49-36-48(40-32-29-39(30-33-40)42-34-31-38-17-13-14-18-41(38)35-42)52(37-51(49)53)54(45-23-9-3-10-24-45)46-25-11-4-12-26-46/h1-12,15-16,19-37H,13-14,17-18H2
InChIKeyAJLKUKLWZRFAIX-UHFFFAOYSA-N
MW691.92 g/mol
LogP13.73
Rot. Bonds7

About N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine

N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine (PubChem CID 170447280) has the molecular formula C53H41N and a molecular weight of 691.92 g/mol. Its IUPAC name is N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine.

Molecular Properties

Compound NameN,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine
PubChem CID170447280
Molecular FormulaC53H41N
Molecular Weight691.92 g/mol
Exact Mass691.32
IUPAC NameN,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine
SMILESc1ccc(N(c2ccccc2)c2cc3c(cc2-c2ccc(-c4ccc5c(c4)CCCC5)cc2)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C53H41N/c1-5-19-43(20-6-1)53(44-21-7-2-8-22-44)50-28-16-15-27-47(50)49-36-48(40-32-29-39(30-33-40)42-34-31-38-17-13-14-18-41(38)35-42)52(37-51(49)53)54(45-23-9-3-10-24-45)46-25-11-4-12-26-46/h1-12,15-16,19-37H,13-14,17-18H2
InChIKeyAJLKUKLWZRFAIX-UHFFFAOYSA-N
XLogP13.73
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500691.92
LogP ≤ 513.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)-3-(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-amine
CID 170447548
9,9-dimethyl-N-phenyl-N-(4-phenylphenyl)-3-(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-amine
CID 170445211
N-(9,9-dimethylfluoren-2-yl)-N-phenyl-3'-(5,6,7,8-tetrahydronaphthalen-2-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 170447564
N-[9,9-diphenyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-yl]-N-(4-phenylphenyl)dibenzothiophen-2-amine
CID 170447579
N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
CID 170448863
3-(2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 170448782
9,9-dimethyl-N-phenyl-N,3-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-amine
CID 170445163
N-phenyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-3'-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)phenyl]-9,9'-spirobi[fluorene]-2'-amine
CID 170448208
N-(4-phenanthren-9-ylphenyl)-N,9,9-triphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170447405
9,9-dimethyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-3-(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-amine
CID 170445933
N,N-bis(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9,9-diphenyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-amine
CID 170448235
3-(2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-N,9,9-triphenyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-amine
CID 170448816

Frequently Asked Questions

What is the IUPAC name of N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine?
The IUPAC name of N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine (CID 170447280) is N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine.
What is the SMILES notation for N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine?
The canonical SMILES for N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine is c1ccc(N(c2ccccc2)c2cc3c(cc2-c2ccc(-c4ccc5c(c4)CCCC5)cc2)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine?
The InChIKey is AJLKUKLWZRFAIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H41N/c1-5-19-43(20-6-1)53(44-21-7-2-8-22-44)50-28-16-15-27-47(50)49-36-48(40-32-29-39(30-33-40)42-34-31-38-17-13-14-18-41(38)35-42)52(37-51(49)53)54(45-23-9-3-10-24-45)46-25-11-4-12-26-46/h1-12,15-16,19-37H,13-14,17-18H2.
What are the key properties of N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine?
N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine has a molecular weight of 691.92 g/mol, XLogP of 13.73, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine is sourced from PubChem (CID 170447280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).