7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene

C53H44 — CID 140710817

IUPAC7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene
SMILESCC(C)c1cc(-c2ccc3c(c2)C(C)(C)c2c-3ccc3c2-c2ccccc2C3(C)C)cc(-c2ccc3cc(-c4ccc5ccccc5c4)ccc3c2)c1
InChIInChI=1S/C53H44/c1-32(2)41-28-42(39-20-19-37-26-36(17-18-38(37)27-39)35-16-15-33-11-7-8-12-34(33)25-35)30-43(29-41)40-21-22-44-45-23-24-48-50(51(45)53(5,6)49(44)31-40)46-13-9-10-14-47(46)52(48,3)4/h7-32H,1-6H3
InChIKeyJSUPNOZECCITSV-UHFFFAOYSA-N
MW680.94 g/mol
LogP14.73
Rot. Bonds4

About 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene

7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene (PubChem CID 140710817) has the molecular formula C53H44 and a molecular weight of 680.94 g/mol. Its IUPAC name is 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene.

Molecular Properties

Compound Name7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene
PubChem CID140710817
Molecular FormulaC53H44
Molecular Weight680.94 g/mol
Exact Mass680.34
IUPAC Name7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene
SMILESCC(C)c1cc(-c2ccc3c(c2)C(C)(C)c2c-3ccc3c2-c2ccccc2C3(C)C)cc(-c2ccc3cc(-c4ccc5ccccc5c4)ccc3c2)c1
InChIInChI=1S/C53H44/c1-32(2)41-28-42(39-20-19-37-26-36(17-18-38(37)27-39)35-16-15-33-11-7-8-12-34(33)25-35)30-43(29-41)40-21-22-44-45-23-24-48-50(51(45)53(5,6)49(44)31-40)46-13-9-10-14-47(46)52(48,3)4/h7-32H,1-6H3
InChIKeyJSUPNOZECCITSV-UHFFFAOYSA-N
XLogP14.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500680.94
LogP ≤ 514.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene 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

11,11,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[2,1-a]fluorene
CID 140710806
9,9-dimethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]fluorene
CID 140710796
7,7,12,12-tetramethyl-2-[4-(6-naphthalen-2-ylnaphthalen-2-yl)naphthalen-2-yl]indeno[1,2-c]fluorene;7,7,12,12-tetramethyl-9-naphthalen-2-yl-2-(6-naphthalen-2-ylnaphthalen-2-yl)indeno[1,2-c]fluorene;9,9,14,14-tetramethyl-6-(6-naphthalen-2-ylnaphthalen-2-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 162101596
9,9,14,14-tetramethyl-6-(6-naphthalen-2-ylnaphthalen-2-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 140710622
6,6,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]indeno[1,2-b]fluorene
CID 140710753
2-(9,9-dimethylfluoren-2-yl)-7-[7-[7-[7-[9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 123392580
2-(9,9-dimethylfluoren-2-yl)-7-[9,9-dimethyl-7-[4-(4-naphthalen-2-ylphenyl)phenyl]fluoren-2-yl]-9,9-dimethylfluorene
CID 123709509
9-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-7,7-dimethylbenzo[c]fluorene
CID 58151561
2,7-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-4-naphthalen-2-ylfluorene
CID 123439239
2-[6-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]naphthalen-2-yl]-9,9-dimethylfluorene
CID 58351434
2-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 59133445
2-(9,9-dimethylfluoren-2-yl)-4-(9,9-dimethylfluoren-4-yl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 170927879

Frequently Asked Questions

What is the IUPAC name of 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene?
The IUPAC name of 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene (CID 140710817) is 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene.
What is the SMILES notation for 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene?
The canonical SMILES for 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene is CC(C)c1cc(-c2ccc3c(c2)C(C)(C)c2c-3ccc3c2-c2ccccc2C3(C)C)cc(-c2ccc3cc(-c4ccc5ccccc5c4)ccc3c2)c1.
What is the InChIKey of 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene?
The InChIKey is JSUPNOZECCITSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H44/c1-32(2)41-28-42(39-20-19-37-26-36(17-18-38(37)27-39)35-16-15-33-11-7-8-12-34(33)25-35)30-43(29-41)40-21-22-44-45-23-24-48-50(51(45)53(5,6)49(44)31-40)46-13-9-10-14-47(46)52(48,3)4/h7-32H,1-6H3.
What are the key properties of 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene?
7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene has a molecular weight of 680.94 g/mol, XLogP of 14.73, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)-5-propan-2-ylphenyl]indeno[1,2-c]fluorene is sourced from PubChem (CID 140710817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).