2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline

C22H15N3 — CID 18470716

IUPAC2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline
SMILESc1ccc2nc(-c3ccc(-c4ccc5ccccc5n4)[nH]3)ccc2c1
InChIInChI=1S/C22H15N3/c1-3-7-17-15(5-1)9-11-19(23-17)21-13-14-22(25-21)20-12-10-16-6-2-4-8-18(16)24-20/h1-14,25H
InChIKeyVIRSFQIJOFMOPY-UHFFFAOYSA-N
MW321.38 g/mol
LogP5.45
Rot. Bonds2

About 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline

2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline (PubChem CID 18470716) has the molecular formula C22H15N3 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline.

Molecular Properties

Compound Name2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline
PubChem CID18470716
Molecular FormulaC22H15N3
Molecular Weight321.38 g/mol
Exact Mass321.13
IUPAC Name2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline
SMILESc1ccc2nc(-c3ccc(-c4ccc5ccccc5n4)[nH]3)ccc2c1
InChIInChI=1S/C22H15N3/c1-3-7-17-15(5-1)9-11-19(23-17)21-13-14-22(25-21)20-12-10-16-6-2-4-8-18(16)24-20/h1-14,25H
InChIKeyVIRSFQIJOFMOPY-UHFFFAOYSA-N
XLogP5.45
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.38
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-quinolin-2-yl-1H-pyrrol-3-yl)quinoline
CID 54524072
2-(7-quinolin-2-ylnaphthalen-2-yl)quinoline
CID 176883836
2-(1H-benzimidazol-2-yl)quinoline
CID 646533
iridium;tris(2-phenylquinoline)
CID 122129463
2-quinolin-2-ylbenzo[b][1,10]phenanthroline
CID 11371746
dichloroplatinum;2-phenylquinoline
CID 175341425
2-(2-fluorophenyl)quinoline
CID 11622684
iridium(3+);bis(2-pyridin-2-ylquinoline)
CID 175803396
3-bromo-5-quinolin-2-yl-1,2,4-thiadiazole
CID 102943376
2-(2,5-dimethylphenyl)quinoline
CID 1202732
2-[3-(2-phenylphenyl)phenyl]quinoline
CID 68954156
(2-quinolin-2-yl-1H-imidazol-5-yl)methanamine
CID 63222608

Frequently Asked Questions

What is the IUPAC name of 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline?
The IUPAC name of 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline (CID 18470716) is 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline.
What is the SMILES notation for 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline?
The canonical SMILES for 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline is c1ccc2nc(-c3ccc(-c4ccc5ccccc5n4)[nH]3)ccc2c1.
What is the InChIKey of 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline?
The InChIKey is VIRSFQIJOFMOPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N3/c1-3-7-17-15(5-1)9-11-19(23-17)21-13-14-22(25-21)20-12-10-16-6-2-4-8-18(16)24-20/h1-14,25H.
What are the key properties of 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline?
2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline has a molecular weight of 321.38 g/mol, XLogP of 5.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline is sourced from PubChem (CID 18470716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).