N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine

C51H39N — CID 170447219

IUPACN-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
SMILESc1ccc(N(c2ccc3ccccc3c2)c2cc3c(cc2-c2cccc4c2CCCC4)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C51H39N/c1-4-21-39(22-5-1)51(40-23-6-2-7-24-40)48-30-15-14-28-45(48)46-34-47(44-29-16-20-37-18-12-13-27-43(37)44)50(35-49(46)51)52(41-25-8-3-9-26-41)42-32-31-36-17-10-11-19-38(36)33-42/h1-11,14-17,19-26,28-35H,12-13,18,27H2
InChIKeyRXBVTRVVTHWWDL-UHFFFAOYSA-N
MW665.88 g/mol
LogP13.22
Rot. Bonds6

About N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine

N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine (PubChem CID 170447219) has the molecular formula C51H39N and a molecular weight of 665.88 g/mol. Its IUPAC name is N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
PubChem CID170447219
Molecular FormulaC51H39N
Molecular Weight665.88 g/mol
Exact Mass665.31
IUPAC NameN-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
SMILESc1ccc(N(c2ccc3ccccc3c2)c2cc3c(cc2-c2cccc4c2CCCC4)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C51H39N/c1-4-21-39(22-5-1)51(40-23-6-2-7-24-40)48-30-15-14-28-45(48)46-34-47(44-29-16-20-37-18-12-13-27-43(37)44)50(35-49(46)51)52(41-25-8-3-9-26-41)42-32-31-36-17-10-11-19-38(36)33-42/h1-11,14-17,19-26,28-35H,12-13,18,27H2
InChIKeyRXBVTRVVTHWWDL-UHFFFAOYSA-N
XLogP13.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500665.88
LogP ≤ 513.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-naphthalen-2-yl-N-phenyl-3'-(5,6,7,8-tetrahydronaphthalen-1-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 170447927
N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-phenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
CID 170445420
N-(4-phenanthren-9-ylphenyl)-N,9,9-triphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170447405
N-(4-phenanthren-9-ylphenyl)-N-phenyl-3'-(5,6,7,8-tetrahydronaphthalen-1-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 170447865
N-phenyl-N-[3'-(5,6,7,8-tetrahydronaphthalen-1-yl)-9,9'-spirobi[fluorene]-2'-yl]dibenzofuran-3-amine
CID 170447930
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3'-(5,6,7,8-tetrahydronaphthalen-1-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 170448848
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
N-(2-phenylphenyl)-N-(4-phenylphenyl)-3'-(5,6,7,8-tetrahydronaphthalen-1-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 170448795
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-(4-naphthalen-2-ylphenyl)-3-phenyl-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170538889
9,9-dimethyl-N-phenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine
CID 170445422

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine?
The IUPAC name of N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine (CID 170447219) is N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine.
What is the SMILES notation for N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine?
The canonical SMILES for N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine is c1ccc(N(c2ccc3ccccc3c2)c2cc3c(cc2-c2cccc4c2CCCC4)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine?
The InChIKey is RXBVTRVVTHWWDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H39N/c1-4-21-39(22-5-1)51(40-23-6-2-7-24-40)48-30-15-14-28-45(48)46-34-47(44-29-16-20-37-18-12-13-27-43(37)44)50(35-49(46)51)52(41-25-8-3-9-26-41)42-32-31-36-17-10-11-19-38(36)33-42/h1-11,14-17,19-26,28-35H,12-13,18,27H2.
What are the key properties of N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine?
N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine has a molecular weight of 665.88 g/mol, XLogP of 13.22, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine is sourced from PubChem (CID 170447219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).