6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole

C32H21N3 — CID 118403794

IUPAC6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole
SMILESc1ccc(-n2c3ccc(-c4ccc(-c5cccc6ccccc56)cn4)cc3c3cccnc32)cc1
InChIInChI=1S/C32H21N3/c1-2-10-25(11-3-1)35-31-18-16-23(20-29(31)28-14-7-19-33-32(28)35)30-17-15-24(21-34-30)27-13-6-9-22-8-4-5-12-26(22)27/h1-21H
InChIKeyWHJKRRODTZLZGO-UHFFFAOYSA-N
MW447.54 g/mol
LogP8.06
Rot. Bonds3

About 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole

6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole (PubChem CID 118403794) has the molecular formula C32H21N3 and a molecular weight of 447.54 g/mol. Its IUPAC name is 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole.

Molecular Properties

Compound Name6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole
PubChem CID118403794
Molecular FormulaC32H21N3
Molecular Weight447.54 g/mol
Exact Mass447.17
IUPAC Name6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole
SMILESc1ccc(-n2c3ccc(-c4ccc(-c5cccc6ccccc56)cn4)cc3c3cccnc32)cc1
InChIInChI=1S/C32H21N3/c1-2-10-25(11-3-1)35-31-18-16-23(20-29(31)28-14-7-19-33-32(28)35)30-17-15-24(21-34-30)27-13-6-9-22-8-4-5-12-26(22)27/h1-21H
InChIKeyWHJKRRODTZLZGO-UHFFFAOYSA-N
XLogP8.06
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.54
LogP ≤ 58.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole
CID 118403810
6-[2-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)-2-naphthalen-1-yl-4-pyridinyl]phenyl]-9-phenylpyrido[2,3-b]indole
CID 88886686
2-[4-(9-phenylpyrido[2,3-b]indol-6-yl)phenyl]-1,10-phenanthroline
CID 118403847
9-phenyl-3-[5-[6-(9-phenylcarbazol-3-yl)-3-pyridinyl]-2-pyridinyl]carbazole
CID 56943928
9-[4-[4-phenanthren-9-yl-6-(5-phenyl-2-pyridinyl)-2-pyridinyl]phenyl]pyrido[2,3-b]indole
CID 59326049
9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole;9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 158404712
9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole;9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 158281604
6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 129221841
9-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-6-(9-phenylcarbazol-1-yl)pyrido[2,3-b]indole
CID 129221443
2-[6-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[2,3-b]indol-9-yl]-1,10-phenanthroline
CID 118403826
2-[4-[4-(9-phenylpyrido[2,3-b]indol-6-yl)cyclohexa-1,3-dien-1-yl]phenyl]-1,10-phenanthroline
CID 146530896
6-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 159460585

Frequently Asked Questions

What is the IUPAC name of 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole?
The IUPAC name of 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole (CID 118403794) is 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole.
What is the SMILES notation for 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole?
The canonical SMILES for 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole is c1ccc(-n2c3ccc(-c4ccc(-c5cccc6ccccc56)cn4)cc3c3cccnc32)cc1.
What is the InChIKey of 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole?
The InChIKey is WHJKRRODTZLZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21N3/c1-2-10-25(11-3-1)35-31-18-16-23(20-29(31)28-14-7-19-33-32(28)35)30-17-15-24(21-34-30)27-13-6-9-22-8-4-5-12-26(22)27/h1-21H.
What are the key properties of 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole?
6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole has a molecular weight of 447.54 g/mol, XLogP of 8.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole is sourced from PubChem (CID 118403794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).