(2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide

C9H15FN2O2 — CID 11275691

IUPAC(2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide
SMILESCC[C@@H](C(N)=O)N1C[C@H](CF)CC1=O
InChIInChI=1S/C9H15FN2O2/c1-2-7(9(11)14)12-5-6(4-10)3-8(12)13/h6-7H,2-5H2,1H3,(H2,11,14)/t6-,7-/m0/s1
InChIKeyKRDBHFRRBKEHEQ-BQBZGAKWSA-N
MW202.23 g/mol
LogP0.07
Rot. Bonds4

About (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide

(2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide (PubChem CID 11275691) has the molecular formula C9H15FN2O2 and a molecular weight of 202.23 g/mol. Its IUPAC name is (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide.

Molecular Properties

Compound Name(2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide
PubChem CID11275691
Molecular FormulaC9H15FN2O2
Molecular Weight202.23 g/mol
Exact Mass202.11
IUPAC Name(2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide
SMILESCC[C@@H](C(N)=O)N1C[C@H](CF)CC1=O
InChIInChI=1S/C9H15FN2O2/c1-2-7(9(11)14)12-5-6(4-10)3-8(12)13/h6-7H,2-5H2,1H3,(H2,11,14)/t6-,7-/m0/s1
InChIKeyKRDBHFRRBKEHEQ-BQBZGAKWSA-N
XLogP0.07
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.23
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide?
The IUPAC name of (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide (CID 11275691) is (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide.
What is the SMILES notation for (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide?
The canonical SMILES for (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide is CC[C@@H](C(N)=O)N1C[C@H](CF)CC1=O.
What is the InChIKey of (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide?
The InChIKey is KRDBHFRRBKEHEQ-BQBZGAKWSA-N. The full InChI is InChI=1S/C9H15FN2O2/c1-2-7(9(11)14)12-5-6(4-10)3-8(12)13/h6-7H,2-5H2,1H3,(H2,11,14)/t6-,7-/m0/s1.
What are the key properties of (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide?
(2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide has a molecular weight of 202.23 g/mol, XLogP of 0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(4R)-4-(fluoromethyl)-2-oxopyrrolidin-1-yl]butanamide is sourced from PubChem (CID 11275691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).