1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one

C20H17N3O — CID 172517347

IUPAC1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one
SMILESO=C1CCCN1c1cc(-c2ccccn2)cc(-c2ccccn2)c1
InChIInChI=1S/C20H17N3O/c24-20-8-5-11-23(20)17-13-15(18-6-1-3-9-21-18)12-16(14-17)19-7-2-4-10-22-19/h1-4,6-7,9-10,12-14H,5,8,11H2
InChIKeyFVSOKHIOXIOHAV-UHFFFAOYSA-N
MW315.38 g/mol
LogP3.94
Rot. Bonds3

About 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one

1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one (PubChem CID 172517347) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one
PubChem CID172517347
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC Name1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one
SMILESO=C1CCCN1c1cc(-c2ccccn2)cc(-c2ccccn2)c1
InChIInChI=1S/C20H17N3O/c24-20-8-5-11-23(20)17-13-15(18-6-1-3-9-21-18)12-16(14-17)19-7-2-4-10-22-19/h1-4,6-7,9-10,12-14H,5,8,11H2
InChIKeyFVSOKHIOXIOHAV-UHFFFAOYSA-N
XLogP3.94
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[4-[6-[3,5-bis(trifluoromethyl)phenyl]-3-pyridinyl]phenyl]-5-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 172517299
1-[3-[4-[5-(3,5-ditert-butylphenyl)-2-pyridinyl]phenyl]-5-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 172517215
1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
CID 70517179
1-[3-(2-phenyl-1,3-thiazol-4-yl)phenyl]pyrrolidin-2-one
CID 9398580
1-[3-[C-methyl-N-(pyridin-2-ylamino)carbonimidoyl]phenyl]pyrrolidin-2-one
CID 71901547
2-(5-pyridin-2-yl-3-pyridinyl)-3,4-dihydroisoquinolin-1-one
CID 175798971
1-[4-[[2-[6-(dimethylamino)-2-pyridin-2-ylpyrimidin-4-yl]ethylamino]methyl]phenyl]pyrrolidin-2-one
CID 46974132
1-(3,5-dimethylphenyl)pyrrolidin-2-one
CID 847897
2-[4-(2-oxopyrrolidin-1-yl)phenoxy]-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
CID 41164403
N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyridine-2-carboxamide
CID 8588320
2-[3-[2-[2-(3,5-dipyridin-2-ylphenyl)phenyl]phenyl]-5-pyridin-2-ylphenyl]pyridine
CID 71534257
1-(3-amino-4-nitro-5-pyrimidin-2-ylphenyl)pyrrolidin-2-one
CID 89362409

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one?
The IUPAC name of 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one (CID 172517347) is 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one?
The canonical SMILES for 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one is O=C1CCCN1c1cc(-c2ccccn2)cc(-c2ccccn2)c1.
What is the InChIKey of 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one?
The InChIKey is FVSOKHIOXIOHAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O/c24-20-8-5-11-23(20)17-13-15(18-6-1-3-9-21-18)12-16(14-17)19-7-2-4-10-22-19/h1-4,6-7,9-10,12-14H,5,8,11H2.
What are the key properties of 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one?
1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one has a molecular weight of 315.38 g/mol, XLogP of 3.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one is sourced from PubChem (CID 172517347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).