7-phenylindolo[2,3-c]isoquinoline

C21H14N2 — CID 140770399

IUPAC7-phenylindolo[2,3-c]isoquinoline
SMILESc1ccc(-n2c3ccccc3c3c4ccccc4cnc32)cc1
InChIInChI=1S/C21H14N2/c1-2-9-16(10-3-1)23-19-13-7-6-12-18(19)20-17-11-5-4-8-15(17)14-22-21(20)23/h1-14H
InChIKeyWECBZSHYBQMMRP-UHFFFAOYSA-N
MW294.36 g/mol
LogP5.33
Rot. Bonds1

About 7-phenylindolo[2,3-c]isoquinoline

7-phenylindolo[2,3-c]isoquinoline (PubChem CID 140770399) has the molecular formula C21H14N2 and a molecular weight of 294.36 g/mol. Its IUPAC name is 7-phenylindolo[2,3-c]isoquinoline.

Molecular Properties

Compound Name7-phenylindolo[2,3-c]isoquinoline
PubChem CID140770399
Molecular FormulaC21H14N2
Molecular Weight294.36 g/mol
Exact Mass294.12
IUPAC Name7-phenylindolo[2,3-c]isoquinoline
SMILESc1ccc(-n2c3ccccc3c3c4ccccc4cnc32)cc1
InChIInChI=1S/C21H14N2/c1-2-9-16(10-3-1)23-19-13-7-6-12-18(19)20-17-11-5-4-8-15(17)14-22-21(20)23/h1-14H
InChIKeyWECBZSHYBQMMRP-UHFFFAOYSA-N
XLogP5.33
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.36
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(3-indolo[2,3-c]isoquinolin-7-ylphenyl)cyclohexa-1,3-dien-1-yl]-triphenylsilane
CID 90732606
3-methyl-9-phenylpyrido[2,3-b]indole
CID 140770387
9-phenylpyrido[2,3-b]indole
CID 15939260
10,20-diphenyl-1,10,12,20-tetrazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-3(11),4,6,8,12,14,16,18-octaene-2,21-dione
CID 170401406
3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-(2,3,4,5,6-pentadeuteriophenyl)carbazole;10-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-7-phenylindolo[2,3-c]isoquinoline;6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole
CID 158339990
7-(4-carbazol-9-ylphenyl)benzo[c]carbazole
CID 70836917
9-phenyl-14-pyrimidin-2-yl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 58038360
3-(9-phenylpyrido[2,3-b]indol-3-yl)-3,19-diazaoctacyclo[17.10.1.02,10.04,9.012,30.013,18.020,29.022,27]triaconta-1,4,6,8,10,12(30),13,15,17,20,22,24,26,28-tetradecaene
CID 130258539
2-(3-carbazol-9-ylphenyl)-9-phenylpyrimido[4,5-b]indole
CID 118232303
3-(9-phenylpyrido[2,3-b]indol-3-yl)-3,19-diazaoctacyclo[17.10.1.02,10.04,9.012,30.013,18.020,29.021,26]triaconta-1,4,6,8,10,12(30),13,15,17,20(29),21,23,25,27-tetradecaene
CID 130259943
3,24-diphenyl-3,12,24-triazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,12,14,16,18,20,22-undecaene
CID 122523763
9-phenyl-23-quinazolin-2-yl-9,23-diazahexacyclo[11.11.0.02,10.03,8.016,24.017,22]tetracosa-1(13),2(10),3,5,7,11,14,16(24),17,19,21-undecaene
CID 122465142

Frequently Asked Questions

What is the IUPAC name of 7-phenylindolo[2,3-c]isoquinoline?
The IUPAC name of 7-phenylindolo[2,3-c]isoquinoline (CID 140770399) is 7-phenylindolo[2,3-c]isoquinoline.
What is the SMILES notation for 7-phenylindolo[2,3-c]isoquinoline?
The canonical SMILES for 7-phenylindolo[2,3-c]isoquinoline is c1ccc(-n2c3ccccc3c3c4ccccc4cnc32)cc1.
What is the InChIKey of 7-phenylindolo[2,3-c]isoquinoline?
The InChIKey is WECBZSHYBQMMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N2/c1-2-9-16(10-3-1)23-19-13-7-6-12-18(19)20-17-11-5-4-8-15(17)14-22-21(20)23/h1-14H.
What are the key properties of 7-phenylindolo[2,3-c]isoquinoline?
7-phenylindolo[2,3-c]isoquinoline has a molecular weight of 294.36 g/mol, XLogP of 5.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylindolo[2,3-c]isoquinoline is sourced from PubChem (CID 140770399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).