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

C38H26N2 — CID 123314968

IUPAC6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole
SMILESc1ccc(-c2ccc(-n3ccc4ccc5c(c43)-c3ccccc3C5(c3ccccc3)c3ccccc3)cn2)cc1
InChIInChI=1S/C38H26N2/c1-4-12-27(13-5-1)35-23-21-31(26-39-35)40-25-24-28-20-22-34-36(37(28)40)32-18-10-11-19-33(32)38(34,29-14-6-2-7-15-29)30-16-8-3-9-17-30/h1-26H
InChIKeyGVNCZPUTYARXCQ-UHFFFAOYSA-N
MW510.64 g/mol
LogP9.06
Rot. Bonds4

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

6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole (PubChem CID 123314968) has the molecular formula C38H26N2 and a molecular weight of 510.64 g/mol. Its IUPAC name is 6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole.

Molecular Properties

Compound Name6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole
PubChem CID123314968
Molecular FormulaC38H26N2
Molecular Weight510.64 g/mol
Exact Mass510.21
IUPAC Name6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole
SMILESc1ccc(-c2ccc(-n3ccc4ccc5c(c43)-c3ccccc3C5(c3ccccc3)c3ccccc3)cn2)cc1
InChIInChI=1S/C38H26N2/c1-4-12-27(13-5-1)35-23-21-31(26-39-35)40-25-24-28-20-22-34-36(37(28)40)32-18-10-11-19-33(32)38(34,29-14-6-2-7-15-29)30-16-8-3-9-17-30/h1-26H
InChIKeyGVNCZPUTYARXCQ-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
2-(9,9-diphenyl-4-pyridin-2-ylfluoren-3-yl)-9-phenyl-1,10-phenanthroline
CID 142453495
6,6-diphenyl-3-(6-pyridin-3-yl-2-pyridinyl)indeno[1,2-e]indole
CID 123952268
2-(11,11-diphenylbenzo[b]fluoren-5-yl)-4,6-diphenylpyrimidine;2-(11,11-diphenylbenzo[b]fluoren-5-yl)-4-naphthalen-2-yl-6-phenylpyrimidine;2-(11,11-diphenylbenzo[b]fluoren-5-yl)-6-phenyl-4-(6-phenyl-3-pyridinyl)pyridine
CID 160756912
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
6,6-diphenyl-3-(4-phenyl-2-pyridinyl)indeno[1,2-e]indole
CID 123751573
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9-diphenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine
CID 155765178
2-(9,9-diphenylfluoren-4-yl)-4-[4-(4-phenylphenyl)phenyl]-6-pyridin-3-ylpyrimidine
CID 154995544
2-[4-(9,9-diphenylfluoren-4-yl)naphthalen-1-yl]-4,6-diphenylpyrimidine
CID 168779478
2-(7,7-diphenylbenzo[c]fluoren-3-yl)-4,6-diphenyl-1,3,5-triazine
CID 155465814
2-(7,7-diphenylbenzo[c]fluoren-4-yl)-4,6-diphenyl-1,3,5-triazine
CID 155465666
3-(4-naphthalen-1-ylphenyl)-16-(6-phenyl-3-pyridinyl)-3,13,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),2(6),4,7,10(15),11,13-heptaene
CID 90078618

Frequently Asked Questions

What is the IUPAC name of 6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole?
The IUPAC name of 6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole (CID 123314968) is 6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole.
What is the SMILES notation for 6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole?
The canonical SMILES for 6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole is c1ccc(-c2ccc(-n3ccc4ccc5c(c43)-c3ccccc3C5(c3ccccc3)c3ccccc3)cn2)cc1.
What is the InChIKey of 6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole?
The InChIKey is GVNCZPUTYARXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26N2/c1-4-12-27(13-5-1)35-23-21-31(26-39-35)40-25-24-28-20-22-34-36(37(28)40)32-18-10-11-19-33(32)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-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole?
6,6-diphenyl-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]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-1-(6-phenyl-3-pyridinyl)indeno[2,1-g]indole is sourced from PubChem (CID 123314968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).