(4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one

C10H11FN2O — CID 26365707

IUPAC(4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one
SMILESN[C@@H]1CC(=O)N(c2cccc(F)c2)C1
InChIInChI=1S/C10H11FN2O/c11-7-2-1-3-9(4-7)13-6-8(12)5-10(13)14/h1-4,8H,5-6,12H2/t8-/m1/s1
InChIKeyHOTFMDGTMULAGL-MRVPVSSYSA-N
MW194.21 g/mol
LogP0.89
Rot. Bonds1

About (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one

(4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one (PubChem CID 26365707) has the molecular formula C10H11FN2O and a molecular weight of 194.21 g/mol. Its IUPAC name is (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one
PubChem CID26365707
Molecular FormulaC10H11FN2O
Molecular Weight194.21 g/mol
Exact Mass194.09
IUPAC Name(4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one
SMILESN[C@@H]1CC(=O)N(c2cccc(F)c2)C1
InChIInChI=1S/C10H11FN2O/c11-7-2-1-3-9(4-7)13-6-8(12)5-10(13)14/h1-4,8H,5-6,12H2/t8-/m1/s1
InChIKeyHOTFMDGTMULAGL-MRVPVSSYSA-N
XLogP0.89
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.21
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-1-(3-bromophenyl)pyrrolidin-2-one
CID 43521015
(4S)-4-amino-1-[4-[2-(3-fluorophenyl)ethyl]phenyl]pyrrolidin-2-one
CID 68614864
4-amino-1-(3-phenylphenyl)pyrrolidin-2-one
CID 168700983
4-amino-1-(3,4-difluorophenyl)pyrrolidin-2-one
CID 43521146
3-(4-amino-2-oxopyrrolidin-1-yl)benzenesulfonic acid
CID 168701174
4-amino-1-(4-fluoro-3-methylphenyl)pyrrolidin-2-one
CID 62813427
ethyl (3S)-1-(3-fluorophenyl)-5-oxopyrrolidine-3-carboxylate
CID 94075742
3-(4-amino-2-oxopyrrolidin-1-yl)-N,N-dimethylbenzamide
CID 168699354
4-amino-1-(3-propoxyphenyl)pyrrolidin-2-one
CID 54792593
4-amino-1-(4-fluoro-2-methylphenyl)pyrrolidin-2-one
CID 43521142
4-amino-1-(3,4-dimethylphenyl)pyrrolidin-2-one;hydrochloride
CID 71779044
4-amino-1-[3-(2-phenylethoxy)phenyl]pyrrolidin-2-one
CID 54792612

Frequently Asked Questions

What is the IUPAC name of (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one?
The IUPAC name of (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one (CID 26365707) is (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one.
What is the SMILES notation for (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one?
The canonical SMILES for (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one is N[C@@H]1CC(=O)N(c2cccc(F)c2)C1.
What is the InChIKey of (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one?
The InChIKey is HOTFMDGTMULAGL-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H11FN2O/c11-7-2-1-3-9(4-7)13-6-8(12)5-10(13)14/h1-4,8H,5-6,12H2/t8-/m1/s1.
What are the key properties of (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one?
(4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one has a molecular weight of 194.21 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-amino-1-(3-fluorophenyl)pyrrolidin-2-one is sourced from PubChem (CID 26365707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).