9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene

C53H34 — CID 158152291

IUPAC9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
SMILESc1ccc2c(c1)Cc1ccc3c(c1-2)-c1cc(-c2ccc4c(c2)-c2ccccc2C4c2cccc4ccccc24)ccc1C3c1ccc2ccccc2c1
InChIInChI=1S/C53H34/c1-2-12-34-28-38(21-20-32(34)10-1)50-46-26-23-36(31-49(46)53-47(50)27-24-39-29-37-13-4-6-16-41(37)51(39)53)35-22-25-45-48(30-35)42-17-7-8-18-44(42)52(45)43-19-9-14-33-11-3-5-15-40(33)43/h1-28,30-31,50,52H,29H2
InChIKeyLHTUDQJBYKANGM-UHFFFAOYSA-N
MW670.86 g/mol
LogP13.55
Rot. Bonds3

About 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene

9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene (PubChem CID 158152291) has the molecular formula C53H34 and a molecular weight of 670.86 g/mol. Its IUPAC name is 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene.

Molecular Properties

Compound Name9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
PubChem CID158152291
Molecular FormulaC53H34
Molecular Weight670.86 g/mol
Exact Mass670.27
IUPAC Name9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
SMILESc1ccc2c(c1)Cc1ccc3c(c1-2)-c1cc(-c2ccc4c(c2)-c2ccccc2C4c2cccc4ccccc24)ccc1C3c1ccc2ccccc2c1
InChIInChI=1S/C53H34/c1-2-12-34-28-38(21-20-32(34)10-1)50-46-26-23-36(31-49(46)53-47(50)27-24-39-29-37-13-4-6-16-41(37)51(39)53)35-22-25-45-48(30-35)42-17-7-8-18-44(42)52(45)43-19-9-14-33-11-3-5-15-40(33)43/h1-28,30-31,50,52H,29H2
InChIKeyLHTUDQJBYKANGM-UHFFFAOYSA-N
XLogP13.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500670.86
LogP ≤ 513.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene 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

7-(9,9-dimethyl-7-phenylfluoren-2-yl)-10-(9H-fluoren-3-yl)-7H-benzo[c]fluorene
CID 123977928
2-[9-[2-(9H-fluoren-4-yl)phenyl]-9H-fluoren-3-yl]-9-phenyl-9H-fluorene
CID 159754601
9-naphthalen-1-yl-14,14-diphenyl-5-[9-(4-phenylphenyl)-9H-fluoren-3-yl]pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 159713563
9-naphthalen-1-yl-3-[4-[(4-phenylphenyl)methyl]phenyl]-9H-fluorene
CID 123329963
9-(9H-fluoren-3-yl)-10-naphthalen-2-ylanthracene
CID 143848174
3-[9-[6-(9H-fluoren-2-yl)naphthalen-2-yl]-9H-fluoren-2-yl]-9-phenyl-9H-fluorene;3-[9-[6-(9H-fluoren-3-yl)naphthalen-2-yl]-9H-fluoren-2-yl]-9-phenyl-9H-fluorene;9-[6-(9H-fluoren-1-yl)naphthalen-2-yl]-2-(9-phenyl-9H-fluoren-3-yl)carbazole
CID 157094709
9-[4-[3-[4-(9H-fluoren-9-yl)phenyl]-5-naphthalen-1-ylphenyl]phenyl]-9H-fluorene
CID 58556083
3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]-9-naphthalen-2-yl-9H-fluorene;3-(9-naphthalen-2-yl-9H-fluoren-3-yl)-9-(3-phenylphenyl)carbazole
CID 161333378
1-[3-[5-phenyl-9-(4-phenylphenyl)-9H-fluoren-3-yl]-9H-fluoren-9-yl]dibenzothiophene
CID 170073483
3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran
CID 126753885
12-naphthalen-2-yl-7,7-diphenyl-3-[9-(3-phenylphenyl)-9H-fluoren-3-yl]-12H-indeno[1,2-c]fluorene
CID 159865494
2,4-diphenyl-6-[4-(12-phenyl-16-hexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaenyl)naphthalen-1-yl]-1,3,5-triazine
CID 156512694

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene?
The IUPAC name of 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene (CID 158152291) is 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene.
What is the SMILES notation for 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene?
The canonical SMILES for 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene is c1ccc2c(c1)Cc1ccc3c(c1-2)-c1cc(-c2ccc4c(c2)-c2ccccc2C4c2cccc4ccccc24)ccc1C3c1ccc2ccccc2c1.
What is the InChIKey of 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene?
The InChIKey is LHTUDQJBYKANGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H34/c1-2-12-34-28-38(21-20-32(34)10-1)50-46-26-23-36(31-49(46)53-47(50)27-24-39-29-37-13-4-6-16-41(37)51(39)53)35-22-25-45-48(30-35)42-17-7-8-18-44(42)52(45)43-19-9-14-33-11-3-5-15-40(33)43/h1-28,30-31,50,52H,29H2.
What are the key properties of 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene?
9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene has a molecular weight of 670.86 g/mol, XLogP of 13.55, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-2-yl-5-(9-naphthalen-1-yl-9H-fluoren-3-yl)pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene is sourced from PubChem (CID 158152291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).