2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole

C32H21N3 — CID 142731155

IUPAC2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole
SMILESc1ccc(-c2c3[nH]c4ccc(-n5c6ccccc6c6ccccc65)cc4c3c3ccccn23)cc1
InChIInChI=1S/C32H21N3/c1-2-10-21(11-3-1)32-31-30(29-16-8-9-19-34(29)32)25-20-22(17-18-26(25)33-31)35-27-14-6-4-12-23(27)24-13-5-7-15-28(24)35/h1-20,33H
InChIKeyHAKFQACTSSBXED-UHFFFAOYSA-N
MW447.54 g/mol
LogP8.34
Rot. Bonds2

About 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole

2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole (PubChem CID 142731155) has the molecular formula C32H21N3 and a molecular weight of 447.54 g/mol. Its IUPAC name is 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole.

Molecular Properties

Compound Name2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole
PubChem CID142731155
Molecular FormulaC32H21N3
Molecular Weight447.54 g/mol
Exact Mass447.17
IUPAC Name2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole
SMILESc1ccc(-c2c3[nH]c4ccc(-n5c6ccccc6c6ccccc65)cc4c3c3ccccn23)cc1
InChIInChI=1S/C32H21N3/c1-2-10-21(11-3-1)32-31-30(29-16-8-9-19-34(29)32)25-20-22(17-18-26(25)33-31)35-27-14-6-4-12-23(27)24-13-5-7-15-28(24)35/h1-20,33H
InChIKeyHAKFQACTSSBXED-UHFFFAOYSA-N
XLogP8.34
TPSA25.13 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.54
LogP ≤ 58.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-phenyl-2-(6-phenylindolizino[2,1-b]indol-5-yl)-5H-indolizino[2,1-b]indole
CID 142731093
2-bromo-6-(3-phenylphenyl)-5H-indolizino[2,1-b]indole
CID 142731215
3-carbazol-9-yl-9-[9-[9-[9-[9-[9-(9H-carbazol-3-yl)carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazole
CID 25208834
5-carbazol-9-yl-9-azapentacyclo[9.8.2.214,17.02,10.03,8]tricosa-1,3(8),4,6,10,14,16,20,22-nonaene
CID 138453883
3,6-di(carbazol-9-yl)-9-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]carbazole
CID 121260661
1,1'-biphenyl;5-[3-(3-phenylphenyl)phenyl]-12H-indolo[3,2-c]carbazole
CID 142615329
3-carbazol-9-yl-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 149208011
9-(9H-carbazol-2-yl)-2-phenylcarbazole
CID 170086059
2-(5,6-diphenylindolizino[2,1-b]indol-2-yl)-5,6-diphenylindolizino[2,1-b]indole
CID 142731173
12-[4-(3-phenylphenyl)phenyl]-11H-indolo[2,3-a]carbazole
CID 165165620
6,12-diphenyl-5H-indolo[3,2-c]carbazole
CID 67494594
12-[9-(9-phenylcarbazol-3-yl)carbazol-4-yl]-11H-indolo[2,3-a]carbazole
CID 170424202

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole?
The IUPAC name of 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole (CID 142731155) is 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole.
What is the SMILES notation for 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole?
The canonical SMILES for 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole is c1ccc(-c2c3[nH]c4ccc(-n5c6ccccc6c6ccccc65)cc4c3c3ccccn23)cc1.
What is the InChIKey of 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole?
The InChIKey is HAKFQACTSSBXED-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21N3/c1-2-10-21(11-3-1)32-31-30(29-16-8-9-19-34(29)32)25-20-22(17-18-26(25)33-31)35-27-14-6-4-12-23(27)24-13-5-7-15-28(24)35/h1-20,33H.
What are the key properties of 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole?
2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole has a molecular weight of 447.54 g/mol, XLogP of 8.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-6-phenyl-5H-indolizino[2,1-b]indole is sourced from PubChem (CID 142731155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).