4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one

C19H17NO — CID 168685806

IUPAC4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one
SMILESC=CC1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
InChIInChI=1S/C19H17NO/c1-2-13-9-19(21)20(12-13)16-7-8-18-15(11-16)10-14-5-3-4-6-17(14)18/h2-8,11,13H,1,9-10,12H2
InChIKeyCCJXFTUZJVRQPB-UHFFFAOYSA-N
MW275.35 g/mol
LogP3.80
Rot. Bonds2

About 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one

4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one (PubChem CID 168685806) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one
PubChem CID168685806
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one
SMILESC=CC1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1
InChIInChI=1S/C19H17NO/c1-2-13-9-19(21)20(12-13)16-7-8-18-15(11-16)10-14-5-3-4-6-17(14)18/h2-8,11,13H,1,9-10,12H2
InChIKeyCCJXFTUZJVRQPB-UHFFFAOYSA-N
XLogP3.80
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one?
The IUPAC name of 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one (CID 168685806) is 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one.
What is the SMILES notation for 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one?
The canonical SMILES for 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one is C=CC1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1.
What is the InChIKey of 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one?
The InChIKey is CCJXFTUZJVRQPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO/c1-2-13-9-19(21)20(12-13)16-7-8-18-15(11-16)10-14-5-3-4-6-17(14)18/h2-8,11,13H,1,9-10,12H2.
What are the key properties of 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one?
4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one has a molecular weight of 275.35 g/mol, XLogP of 3.80, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1-(9H-fluoren-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 168685806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).