5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole

C44H30N2 — CID 118895360

IUPAC5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole
SMILESCc1cccc(-c2cccc(-c3cc4c(c5ccccc35)c3ccc(-c5ccc6ccccc6c5)cc3n4-c3ccccc3)c2)n1
InChIInChI=1S/C44H30N2/c1-29-11-9-20-41(45-29)35-15-10-14-34(26-35)40-28-43-44(38-19-8-7-18-37(38)40)39-24-23-33(27-42(39)46(43)36-16-3-2-4-17-36)32-22-21-30-12-5-6-13-31(30)25-32/h2-28H,1H3
InChIKeyRDQXYGNSBKXEAN-UHFFFAOYSA-N
MW586.74 g/mol
LogP11.79
Rot. Bonds4

About 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole

5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole (PubChem CID 118895360) has the molecular formula C44H30N2 and a molecular weight of 586.74 g/mol. Its IUPAC name is 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole.

Molecular Properties

Compound Name5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole
PubChem CID118895360
Molecular FormulaC44H30N2
Molecular Weight586.74 g/mol
Exact Mass586.24
IUPAC Name5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole
SMILESCc1cccc(-c2cccc(-c3cc4c(c5ccccc35)c3ccc(-c5ccc6ccccc6c5)cc3n4-c3ccccc3)c2)n1
InChIInChI=1S/C44H30N2/c1-29-11-9-20-41(45-29)35-15-10-14-34(26-35)40-28-43-44(38-19-8-7-18-37(38)40)39-24-23-33(27-42(39)46(43)36-16-3-2-4-17-36)32-22-21-30-12-5-6-13-31(30)25-32/h2-28H,1H3
InChIKeyRDQXYGNSBKXEAN-UHFFFAOYSA-N
XLogP11.79
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500586.74
LogP ≤ 511.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-2-[3-(6-methyl-2-pyridinyl)phenyl]-7-naphthalen-1-yl-9-phenyl-3-[(Z)-prop-1-enyl]carbazole
CID 144734436
7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole
CID 163423913
9-[3-(2-methylphenyl)phenyl]-7-phenylbenzo[c]carbazole
CID 90175676
9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole
CID 135249802
3,6-bis(6-naphthalen-2-yl-2-pyridinyl)-9-phenylcarbazole
CID 163724043
3-(9-naphthalen-2-ylcarbazol-2-yl)-9-[3-(6-phenyl-2-pyridinyl)phenyl]carbazole
CID 118508713
9-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-7-phenylbenzo[c]carbazole;10-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-7-phenylbenzo[c]carbazole;5-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;9-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;9-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-7-phenylbenzo[c]carbazole;10-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;10-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-7-phenylbenzo[c]carbazole
CID 159515250
9-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-7-phenylbenzo[c]carbazole;5-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;5-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-7-phenylbenzo[c]carbazole
CID 160604847
4,4,5,5-tetramethyl-2-[5-(9-naphthalen-2-yl-7-phenylbenzo[c]carbazol-5-yl)-2-pyridinyl]-1,3-oxazole
CID 135249789
2-(6-naphthalen-1-ylnaphthalen-2-yl)-7-phenylbenzo[c]carbazole
CID 130351342
5-[3-[9-[3-(5-cyano-3-pyridinyl)phenyl]-7-phenylbenzo[c]carbazol-5-yl]phenyl]pyridine-3-carbonitrile
CID 118397718
7-phenyl-4,9-di(pyren-2-yl)benzo[c]carbazole
CID 139341378

Frequently Asked Questions

What is the IUPAC name of 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole?
The IUPAC name of 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole (CID 118895360) is 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole.
What is the SMILES notation for 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole?
The canonical SMILES for 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole is Cc1cccc(-c2cccc(-c3cc4c(c5ccccc35)c3ccc(-c5ccc6ccccc6c5)cc3n4-c3ccccc3)c2)n1.
What is the InChIKey of 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole?
The InChIKey is RDQXYGNSBKXEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H30N2/c1-29-11-9-20-41(45-29)35-15-10-14-34(26-35)40-28-43-44(38-19-8-7-18-37(38)40)39-24-23-33(27-42(39)46(43)36-16-3-2-4-17-36)32-22-21-30-12-5-6-13-31(30)25-32/h2-28H,1H3.
What are the key properties of 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole?
5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole has a molecular weight of 586.74 g/mol, XLogP of 11.79, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole is sourced from PubChem (CID 118895360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).