6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole

C38H26N2 — CID 123751573

IUPAC6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole
SMILESc1ccc(-c2ccnc(-n3ccc4c5c(ccc43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)c2)cc1
InChIInChI=1S/C38H26N2/c1-4-12-27(13-5-1)28-22-24-39-36(26-28)40-25-23-32-35(40)21-20-34-37(32)31-18-10-11-19-33(31)38(34,29-14-6-2-7-15-29)30-16-8-3-9-17-30/h1-26H
InChIKeyGBSQKFPOVQFYNL-UHFFFAOYSA-N
MW510.64 g/mol
LogP9.06
Rot. Bonds4

About 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole

6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole (PubChem CID 123751573) has the molecular formula C38H26N2 and a molecular weight of 510.64 g/mol. Its IUPAC name is 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole.

Molecular Properties

Compound Name6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole
PubChem CID123751573
Molecular FormulaC38H26N2
Molecular Weight510.64 g/mol
Exact Mass510.21
IUPAC Name6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole
SMILESc1ccc(-c2ccnc(-n3ccc4c5c(ccc43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)c2)cc1
InChIInChI=1S/C38H26N2/c1-4-12-27(13-5-1)28-22-24-39-36(26-28)40-25-23-32-35(40)21-20-34-37(32)31-18-10-11-19-33(31)38(34,29-14-6-2-7-15-29)30-16-8-3-9-17-30/h1-26H
InChIKeyGBSQKFPOVQFYNL-UHFFFAOYSA-N
XLogP9.06
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.64
LogP ≤ 59.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,6-diphenyl-4-pyridinyl)-6,6-diphenylindeno[1,2-e]indole
CID 90130569
6,6-diphenyl-3-(6-pyridin-3-yl-2-pyridinyl)indeno[1,2-e]indole
CID 123952268
4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 164785729
9-methyl-14,14-diphenyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 126632479
3,9,9-triphenylfluorene
CID 140844354
15-methyl-10,10,20,20-tetraphenyl-15-azaheptacyclo[14.11.0.02,14.03,11.04,9.019,27.021,26]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19(27),21,23,25-dodecaene
CID 142380452
6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole
CID 161056569
7,7-diphenyl-12-(3-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]indeno[1,2-a]carbazole
CID 121343577
2-phenyl-4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 134487429
2,4-diphenyl-6-[4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-[4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]phenyl]-6-(4-phenylphenyl)-1,3,5-triazine;2-phenyl-4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 158764717
2-(7,7-diphenylbenzo[c]fluoren-3-yl)-4,6-diphenyl-1,3,5-triazine
CID 155465814
7,7-diphenyl-5-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]benzo[c]fluorene
CID 158070567

Frequently Asked Questions

What is the IUPAC name of 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole?
The IUPAC name of 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole (CID 123751573) is 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole.
What is the SMILES notation for 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole?
The canonical SMILES for 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole is c1ccc(-c2ccnc(-n3ccc4c5c(ccc43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)c2)cc1.
What is the InChIKey of 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole?
The InChIKey is GBSQKFPOVQFYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26N2/c1-4-12-27(13-5-1)28-22-24-39-36(26-28)40-25-23-32-35(40)21-20-34-37(32)31-18-10-11-19-33(31)38(34,29-14-6-2-7-15-29)30-16-8-3-9-17-30/h1-26H.
What are the key properties of 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole?
6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole has a molecular weight of 510.64 g/mol, XLogP of 9.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole is sourced from PubChem (CID 123751573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).