(5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one

C17H16FNO — CID 102261504

IUPAC(5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one
SMILESO=C1CC[C@@H](C(F)(c2ccccc2)c2ccccc2)N1
InChIInChI=1S/C17H16FNO/c18-17(13-7-3-1-4-8-13,14-9-5-2-6-10-14)15-11-12-16(20)19-15/h1-10,15H,11-12H2,(H,19,20)/t15-/m0/s1
InChIKeyBGBIVPNUIOSULY-HNNXBMFYSA-N
MW269.32 g/mol
LogP3.18
Rot. Bonds3

About (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one

(5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one (PubChem CID 102261504) has the molecular formula C17H16FNO and a molecular weight of 269.32 g/mol. Its IUPAC name is (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one
PubChem CID102261504
Molecular FormulaC17H16FNO
Molecular Weight269.32 g/mol
Exact Mass269.12
IUPAC Name(5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one
SMILESO=C1CC[C@@H](C(F)(c2ccccc2)c2ccccc2)N1
InChIInChI=1S/C17H16FNO/c18-17(13-7-3-1-4-8-13,14-9-5-2-6-10-14)15-11-12-16(20)19-15/h1-10,15H,11-12H2,(H,19,20)/t15-/m0/s1
InChIKeyBGBIVPNUIOSULY-HNNXBMFYSA-N
XLogP3.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one?
The IUPAC name of (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one (CID 102261504) is (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one.
What is the SMILES notation for (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one?
The canonical SMILES for (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one is O=C1CC[C@@H](C(F)(c2ccccc2)c2ccccc2)N1.
What is the InChIKey of (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one?
The InChIKey is BGBIVPNUIOSULY-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H16FNO/c18-17(13-7-3-1-4-8-13,14-9-5-2-6-10-14)15-11-12-16(20)19-15/h1-10,15H,11-12H2,(H,19,20)/t15-/m0/s1.
What are the key properties of (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one?
(5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one has a molecular weight of 269.32 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[fluoro(diphenyl)methyl]pyrrolidin-2-one is sourced from PubChem (CID 102261504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).