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

C53H41N — CID 170448863

IUPACN,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
SMILESc1ccc(-c2ccc3c(c2-c2cc4c(cc2N(c2ccccc2)c2ccccc2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)CCCC3)cc1
InChIInChI=1S/C53H41N/c1-6-20-38(21-7-1)45-35-34-39-22-16-17-31-44(39)52(45)48-36-47-46-32-18-19-33-49(46)53(40-23-8-2-9-24-40,41-25-10-3-11-26-41)50(47)37-51(48)54(42-27-12-4-13-28-42)43-29-14-5-15-30-43/h1-15,18-21,23-30,32-37H,16-17,22,31H2
InChIKeyYRMRDGYLXULAGY-UHFFFAOYSA-N
MW691.92 g/mol
LogP13.73
Rot. Bonds7

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

N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine (PubChem CID 170448863) has the molecular formula C53H41N and a molecular weight of 691.92 g/mol. Its IUPAC name is N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine.

Molecular Properties

Compound NameN,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
PubChem CID170448863
Molecular FormulaC53H41N
Molecular Weight691.92 g/mol
Exact Mass691.32
IUPAC NameN,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
SMILESc1ccc(-c2ccc3c(c2-c2cc4c(cc2N(c2ccccc2)c2ccccc2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)CCCC3)cc1
InChIInChI=1S/C53H41N/c1-6-20-38(21-7-1)45-35-34-39-22-16-17-31-44(39)52(45)48-36-47-46-32-18-19-33-49(46)53(40-23-8-2-9-24-40,41-25-10-3-11-26-41)50(47)37-51(48)54(42-27-12-4-13-28-42)43-29-14-5-15-30-43/h1-15,18-21,23-30,32-37H,16-17,22,31H2
InChIKeyYRMRDGYLXULAGY-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

Analyze N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 170448782
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,N,9,9-tetraphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]fluoren-2-amine
CID 170447280
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-naphthalen-2-yl-N,9,9-triphenyl-3-(5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine
CID 170447219
2-N-(9,9-diphenylfluoren-3-yl)-2-N,2-N',2-N',3'-tetraphenyl-9,9'-spirobi[fluorene]-2,2'-diamine
CID 168791813
N,9,9-triphenyl-3-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine
CID 170447411
N,9,9-triphenyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-3-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)phenyl]fluoren-2-amine
CID 170447384
N-(2-phenylphenyl)-N-(4-phenylphenyl)-3'-(5,6,7,8-tetrahydronaphthalen-1-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 170448795
3'-(2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)-N-(4-phenylphenyl)-N-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-9,9'-spirobi[fluorene]-2'-amine
CID 170449441
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

Frequently Asked Questions

What is the IUPAC name of N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine?
The IUPAC name of N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine (CID 170448863) is N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine.
What is the SMILES notation for N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine?
The canonical SMILES for N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine is c1ccc(-c2ccc3c(c2-c2cc4c(cc2N(c2ccccc2)c2ccccc2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)CCCC3)cc1.
What is the InChIKey of N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine?
The InChIKey is YRMRDGYLXULAGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H41N/c1-6-20-38(21-7-1)45-35-34-39-22-16-17-31-44(39)52(45)48-36-47-46-32-18-19-33-49(46)53(40-23-8-2-9-24-40,41-25-10-3-11-26-41)50(47)37-51(48)54(42-27-12-4-13-28-42)43-29-14-5-15-30-43/h1-15,18-21,23-30,32-37H,16-17,22,31H2.
What are the key properties of N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine?
N,N,9,9-tetraphenyl-3-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)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-(2-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)fluoren-2-amine is sourced from PubChem (CID 170448863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).