2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline

C37H23N3 — CID 164780916

IUPAC2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline
SMILESc1ccc2cc(-c3ccc4ccc(-c5ccc6ccc(-c7cccc8ncccc78)nc6c5)cc4n3)ccc2c1
InChIInChI=1S/C37H23N3/c1-2-6-27-21-30(15-10-24(27)5-1)33-18-16-25-11-13-28(22-36(25)39-33)29-14-12-26-17-19-35(40-37(26)23-29)32-7-3-9-34-31(32)8-4-20-38-34/h1-23H
InChIKeyQGCSZXQDAPTYCR-UHFFFAOYSA-N
MW509.61 g/mol
LogP9.49
Rot. Bonds3

About 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline

2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline (PubChem CID 164780916) has the molecular formula C37H23N3 and a molecular weight of 509.61 g/mol. Its IUPAC name is 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline.

Molecular Properties

Compound Name2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline
PubChem CID164780916
Molecular FormulaC37H23N3
Molecular Weight509.61 g/mol
Exact Mass509.19
IUPAC Name2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline
SMILESc1ccc2cc(-c3ccc4ccc(-c5ccc6ccc(-c7cccc8ncccc78)nc6c5)cc4n3)ccc2c1
InChIInChI=1S/C37H23N3/c1-2-6-27-21-30(15-10-24(27)5-1)33-18-16-25-11-13-28(22-36(25)39-33)29-14-12-26-17-19-35(40-37(26)23-29)32-7-3-9-34-31(32)8-4-20-38-34/h1-23H
InChIKeyQGCSZXQDAPTYCR-UHFFFAOYSA-N
XLogP9.49
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500509.61
LogP ≤ 59.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-[7-(2-quinolin-4-ylquinolin-7-yl)quinolin-2-yl]naphthalen-2-yl]-1,10-phenanthroline
CID 164780760
2-naphthalen-2-yl-9-[4-[2-[2-(1,10-phenanthrolin-5-yl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline
CID 164779383
2-[4-[6-[2-(1,10-phenanthrolin-4-yl)quinolin-7-yl]quinolin-2-yl]naphthalen-1-yl]-1,10-phenanthroline;2-[6-[6-[2-(1,10-phenanthrolin-4-yl)quinolin-7-yl]quinolin-2-yl]naphthalen-2-yl]-1,10-phenanthroline
CID 165104577
2-[6-[7-[2-(1,10-phenanthrolin-4-yl)quinolin-7-yl]quinolin-2-yl]naphthalen-2-yl]-1,10-phenanthroline
CID 164780808
7-naphthalen-1-yl-2-(2-quinolin-8-ylquinolin-7-yl)quinoline;7-phenyl-2-(2-quinolin-8-ylquinolin-7-yl)quinoline
CID 164992438
2-[7-(2-naphthalen-2-ylquinolin-6-yl)quinolin-2-yl]-1,10-phenanthroline;2-[7-(2-phenanthren-9-ylquinolin-6-yl)quinolin-2-yl]-1,10-phenanthroline;2-[6-[2-(1,10-phenanthrolin-2-yl)quinolin-7-yl]quinolin-2-yl]-1,10-phenanthroline
CID 165008986
2-[4-[7-(2-naphthalen-2-ylquinolin-6-yl)quinolin-2-yl]phenyl]-1,10-phenanthroline
CID 155023263
2-[4-[7-[2-(3,5-diphenylphenyl)quinolin-7-yl]quinolin-2-yl]naphthalen-1-yl]-1,10-phenanthroline;2-[4-[7-(2-naphthalen-1-ylquinolin-7-yl)quinolin-2-yl]naphthalen-1-yl]-1,10-phenanthroline;2-[4-[7-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-2-yl]naphthalen-1-yl]-1,10-phenanthroline;2-[4-[7-[2-(4-phenylphenyl)quinolin-7-yl]quinolin-2-yl]naphthalen-1-yl]-1,10-phenanthroline
CID 164989934
2-naphthalen-1-yl-6-(2-pyridin-4-ylquinolin-7-yl)quinoline
CID 155023288
5-[7-(2-naphthalen-2-ylquinolin-6-yl)quinolin-2-yl]-1,10-phenanthroline;5-[7-(2-phenanthren-9-ylquinolin-6-yl)quinolin-2-yl]-1,10-phenanthroline;5-[7-(2-phenylquinolin-6-yl)quinolin-2-yl]-1,10-phenanthroline
CID 165086971
2-[4-[7-(2-pyridin-4-ylquinolin-7-yl)quinolin-2-yl]naphthalen-1-yl]-1,10-phenanthroline
CID 164780676
2-[4-[7-(2-triphenylen-2-ylquinolin-7-yl)quinolin-2-yl]phenyl]-1,10-phenanthroline
CID 164780738

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline?
The IUPAC name of 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline (CID 164780916) is 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline.
What is the SMILES notation for 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline?
The canonical SMILES for 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline is c1ccc2cc(-c3ccc4ccc(-c5ccc6ccc(-c7cccc8ncccc78)nc6c5)cc4n3)ccc2c1.
What is the InChIKey of 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline?
The InChIKey is QGCSZXQDAPTYCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H23N3/c1-2-6-27-21-30(15-10-24(27)5-1)33-18-16-25-11-13-28(22-36(25)39-33)29-14-12-26-17-19-35(40-37(26)23-29)32-7-3-9-34-31(32)8-4-20-38-34/h1-23H.
What are the key properties of 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline?
2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline has a molecular weight of 509.61 g/mol, XLogP of 9.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yl-7-(2-quinolin-5-ylquinolin-7-yl)quinoline is sourced from PubChem (CID 164780916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).