(5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one

C10H9F2NO — CID 130659589

IUPAC(5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one
SMILESO=C1CC[C@H](c2cc(F)cc(F)c2)N1
InChIInChI=1S/C10H9F2NO/c11-7-3-6(4-8(12)5-7)9-1-2-10(14)13-9/h3-5,9H,1-2H2,(H,13,14)/t9-/m1/s1
InChIKeyOWGSUNHQOOOHBW-SECBINFHSA-N
MW197.18 g/mol
LogP1.92
Rot. Bonds1

About (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one

(5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one (PubChem CID 130659589) has the molecular formula C10H9F2NO and a molecular weight of 197.18 g/mol. Its IUPAC name is (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one
PubChem CID130659589
Molecular FormulaC10H9F2NO
Molecular Weight197.18 g/mol
Exact Mass197.07
IUPAC Name(5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one
SMILESO=C1CC[C@H](c2cc(F)cc(F)c2)N1
InChIInChI=1S/C10H9F2NO/c11-7-3-6(4-8(12)5-7)9-1-2-10(14)13-9/h3-5,9H,1-2H2,(H,13,14)/t9-/m1/s1
InChIKeyOWGSUNHQOOOHBW-SECBINFHSA-N
XLogP1.92
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.18
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one?
The IUPAC name of (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one (CID 130659589) is (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one.
What is the SMILES notation for (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one?
The canonical SMILES for (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one is O=C1CC[C@H](c2cc(F)cc(F)c2)N1.
What is the InChIKey of (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one?
The InChIKey is OWGSUNHQOOOHBW-SECBINFHSA-N. The full InChI is InChI=1S/C10H9F2NO/c11-7-3-6(4-8(12)5-7)9-1-2-10(14)13-9/h3-5,9H,1-2H2,(H,13,14)/t9-/m1/s1.
What are the key properties of (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one?
(5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one has a molecular weight of 197.18 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(3,5-difluorophenyl)pyrrolidin-2-one is sourced from PubChem (CID 130659589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).