2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile

C32H18N4 — CID 130352969

IUPAC2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile
SMILESN#Cc1ccccc1-n1c2ccccc2c2c1ccc1c3ccccc3n(-c3ccccc3C#N)c12
InChIInChI=1S/C32H18N4/c33-19-21-9-1-5-13-26(21)35-29-16-8-4-12-25(29)31-30(35)18-17-24-23-11-3-7-15-28(23)36(32(24)31)27-14-6-2-10-22(27)20-34/h1-18H
InChIKeyVWNOYDOQQRWJNR-UHFFFAOYSA-N
MW458.52 g/mol
LogP7.62
Rot. Bonds2

About 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile

2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile (PubChem CID 130352969) has the molecular formula C32H18N4 and a molecular weight of 458.52 g/mol. Its IUPAC name is 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile.

Molecular Properties

Compound Name2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile
PubChem CID130352969
Molecular FormulaC32H18N4
Molecular Weight458.52 g/mol
Exact Mass458.15
IUPAC Name2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile
SMILESN#Cc1ccccc1-n1c2ccccc2c2c1ccc1c3ccccc3n(-c3ccccc3C#N)c12
InChIInChI=1S/C32H18N4/c33-19-21-9-1-5-13-26(21)35-29-16-8-4-12-25(29)31-30(35)18-17-24-23-11-3-7-15-28(23)36(32(24)31)27-14-6-2-10-22(27)20-34/h1-18H
InChIKeyVWNOYDOQQRWJNR-UHFFFAOYSA-N
XLogP7.62
TPSA57.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.52
LogP ≤ 57.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-benzo[a]carbazol-11-ylbenzonitrile;2-benzo[c]carbazol-7-ylbenzonitrile;ethane
CID 145009970
6-(2-cyanophenyl)-15,24-diphenyl-6,15,24-triazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7(12),8,10,17(25),18,20,22,26-dodecaene-10-carbonitrile
CID 146180219
4-(5-phenylindolo[3,2-c]carbazol-12-yl)naphthalene-1-carbonitrile
CID 170268509
4-phenyl-2-(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile
CID 170050483
2-[4-[12-[4-(2-cyanophenyl)phenyl]indolo[3,2-c]carbazol-5-yl]phenyl]benzonitrile
CID 135252875
24-(2-cyanophenyl)-6,15-diphenyl-6,15,24-triazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene-11-carbonitrile;2-[6-(3-cyanophenyl)-24-phenyl-6,15,24-triazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaen-15-yl]benzonitrile;2-(6,24-diphenyl-6,15,24-triazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaen-15-yl)benzene-1,3-dicarbonitrile
CID 157229706
2-[4-[9-(4-cyanophenyl)carbazol-1-yl]carbazol-9-yl]benzonitrile
CID 139351874
2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzene-1,3-dicarbonitrile
CID 166572232
12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole
CID 130417453
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)benzonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(5-phenylindolo[3,2-b]carbazol-11-yl)benzonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(12-phenylindolo[3,2-c]carbazol-5-yl)benzonitrile
CID 163795188
4-(2-cyanophenyl)-2-(18,27-diphenyl-9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaen-9-yl)-6-(12-phenylindolo[3,2-c]carbazol-5-yl)benzonitrile
CID 170051061
4-carbazol-9-yl-3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)benzonitrile
CID 163573400

Frequently Asked Questions

What is the IUPAC name of 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile?
The IUPAC name of 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile (CID 130352969) is 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile.
What is the SMILES notation for 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile?
The canonical SMILES for 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile is N#Cc1ccccc1-n1c2ccccc2c2c1ccc1c3ccccc3n(-c3ccccc3C#N)c12.
What is the InChIKey of 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile?
The InChIKey is VWNOYDOQQRWJNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H18N4/c33-19-21-9-1-5-13-26(21)35-29-16-8-4-12-25(29)31-30(35)18-17-24-23-11-3-7-15-28(23)36(32(24)31)27-14-6-2-10-22(27)20-34/h1-18H.
What are the key properties of 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile?
2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile has a molecular weight of 458.52 g/mol, XLogP of 7.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[12-(2-cyanophenyl)indolo[3,2-c]carbazol-5-yl]benzonitrile is sourced from PubChem (CID 130352969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).