2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile

C130H86N10 — CID 158511731

IUPAC2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3c5ccccc5ccc3n4-c3cc(C#N)c4ccccc4n3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3c5ccccc5ccc3n4-c3ccc(-c4cc(C#N)c5ccccc5n4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3cc(-c5ccccc5)ccc3n4-c3nc(C#N)c4ccccc4n3)cc21
InChIInChI=1S/C47H31N3.C42H28N4.C41H27N3/c1-47(2)40-13-7-5-12-37(40)38-22-17-32(26-41(38)47)31-19-23-44-39(25-31)46-36-11-4-3-9-29(36)18-24-45(46)50(44)34-20-15-30(16-21-34)43-27-33(28-48)35-10-6-8-14-42(35)49-43;1-42(2)35-14-8-6-12-30(35)31-19-16-29(24-36(31)42)28-18-21-40-34(23-28)33-22-27(26-10-4-3-5-11-26)17-20-39(33)46(40)41-44-37-15-9-7-13-32(37)38(25-43)45-41;1-41(2)34-13-7-5-12-31(34)32-18-15-27(22-35(32)41)26-17-19-37-33(21-26)40-30-11-4-3-9-25(30)16-20-38(40)44(37)39-23-28(24-42)29-10-6-8-14-36(29)43-39/h3-27H,1-2H3;3-24H,1-2H3;3-23H,1-2H3
InChIKeyHLDIBUYARROPMQ-UHFFFAOYSA-N
MW1788.19 g/mol
LogP32.57
Rot. Bonds8

About 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile

2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile (PubChem CID 158511731) has the molecular formula C130H86N10 and a molecular weight of 1788.19 g/mol. Its IUPAC name is 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile.

Molecular Properties

Compound Name2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile
PubChem CID158511731
Molecular FormulaC130H86N10
Molecular Weight1788.19 g/mol
Exact Mass1786.70
IUPAC Name2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3c5ccccc5ccc3n4-c3cc(C#N)c4ccccc4n3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3c5ccccc5ccc3n4-c3ccc(-c4cc(C#N)c5ccccc5n4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3cc(-c5ccccc5)ccc3n4-c3nc(C#N)c4ccccc4n3)cc21
InChIInChI=1S/C47H31N3.C42H28N4.C41H27N3/c1-47(2)40-13-7-5-12-37(40)38-22-17-32(26-41(38)47)31-19-23-44-39(25-31)46-36-11-4-3-9-29(36)18-24-45(46)50(44)34-20-15-30(16-21-34)43-27-33(28-48)35-10-6-8-14-42(35)49-43;1-42(2)35-14-8-6-12-30(35)31-19-16-29(24-36(31)42)28-18-21-40-34(23-28)33-22-27(26-10-4-3-5-11-26)17-20-39(33)46(40)41-44-37-15-9-7-13-32(37)38(25-43)45-41;1-41(2)34-13-7-5-12-31(34)32-18-15-27(22-35(32)41)26-17-19-37-33(21-26)40-30-11-4-3-9-25(30)16-20-38(40)44(37)39-23-28(24-42)29-10-6-8-14-36(29)43-39/h3-27H,1-2H3;3-24H,1-2H3;3-23H,1-2H3
InChIKeyHLDIBUYARROPMQ-UHFFFAOYSA-N
XLogP32.57
TPSA137.72 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms140
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001788.19
LogP ≤ 532.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile with MolForge

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Related Compounds

2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile
CID 121337914
2-(10-benzo[c]carbazol-7-ylbenzo[c]carbazol-7-yl)quinazoline-4-carbonitrile;2-[10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[4-[10-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile
CID 157146532
2-[10-(7-phenylbenzo[c]carbazol-5-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[10-(7-phenylbenzo[c]carbazol-5-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile
CID 161057241
2-[3-(7,7-dimethylbenzo[c]fluoren-10-yl)carbazol-9-yl]quinazoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-7-fluoroquinoline-4-carbonitrile;2-[4-(4-phenanthren-3-ylcarbazol-9-yl)phenyl]quinazoline-4-carbonitrile;2-[4-(4-phenanthren-3-ylcarbazol-9-yl)phenyl]quinoline-4-carbonitrile
CID 159756016
2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-[6-phenyl-9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]quinazoline-4-carbonitrile;2-[3-[6-phenyl-9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]quinoline-4-carbonitrile
CID 159941374
3-[9-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]carbazol-3-yl]-9-(9,9-dimethylfluoren-2-yl)-6-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]carbazole;9-(9,9-dimethylfluoren-2-yl)-3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-6-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]carbazole
CID 160991667
2-[10-(4-naphthalen-1-ylphenyl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile
CID 121337949
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole
CID 58511641
2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile
CID 162155055
10-(9,9-dimethylfluoren-2-yl)-7-(1,2,9-triphenylpyrrolo[2,3-f]quinazolin-7-yl)benzo[c]carbazole
CID 131998610
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[4-(7-phenylbenzo[c]carbazol-10-yl)phenyl]fluoren-2-amine
CID 70853904
3-(9,9-dimethylfluoren-2-yl)-5-(2,6-diphenylpyrimidin-4-yl)-9-(4-phenylphenyl)carbazole
CID 163759437

Frequently Asked Questions

What is the IUPAC name of 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile?
The IUPAC name of 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile (CID 158511731) is 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile.
What is the SMILES notation for 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile?
The canonical SMILES for 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile is CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3c5ccccc5ccc3n4-c3cc(C#N)c4ccccc4n3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3c5ccccc5ccc3n4-c3ccc(-c4cc(C#N)c5ccccc5n4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3cc(-c5ccccc5)ccc3n4-c3nc(C#N)c4ccccc4n3)cc21.
What is the InChIKey of 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile?
The InChIKey is HLDIBUYARROPMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H31N3.C42H28N4.C41H27N3/c1-47(2)40-13-7-5-12-37(40)38-22-17-32(26-41(38)47)31-19-23-44-39(25-31)46-36-11-4-3-9-29(36)18-24-45(46)50(44)34-20-15-30(16-21-34)43-27-33(28-48)35-10-6-8-14-42(35)49-43;1-42(2)35-14-8-6-12-30(35)31-19-16-29(24-36(31)42)28-18-21-40-34(23-28)33-22-27(26-10-4-3-5-11-26)17-20-39(33)46(40)41-44-37-15-9-7-13-32(37)38(25-43)45-41;1-41(2)34-13-7-5-12-31(34)32-18-15-27(22-35(32)41)26-17-19-37-33(21-26)40-30-11-4-3-9-25(30)16-20-38(40)44(37)39-23-28(24-42)29-10-6-8-14-36(29)43-39/h3-27H,1-2H3;3-24H,1-2H3;3-23H,1-2H3.
What are the key properties of 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile?
2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile has a molecular weight of 1788.19 g/mol, XLogP of 32.57, 8 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile is sourced from PubChem (CID 158511731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).