(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone

C10H15FN2O — CID 131091783

IUPAC(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone
SMILESO=C(C1CCCN1)N1CCC=C(F)C1
InChIInChI=1S/C10H15FN2O/c11-8-3-2-6-13(7-8)10(14)9-4-1-5-12-9/h3,9,12H,1-2,4-7H2
InChIKeyOWSMQGJGNZQNAY-UHFFFAOYSA-N
MW198.24 g/mol
LogP0.82
Rot. Bonds1

About (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone

(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone (PubChem CID 131091783) has the molecular formula C10H15FN2O and a molecular weight of 198.24 g/mol. Its IUPAC name is (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone.

Molecular Properties

Compound Name(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone
PubChem CID131091783
Molecular FormulaC10H15FN2O
Molecular Weight198.24 g/mol
Exact Mass198.12
IUPAC Name(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone
SMILESO=C(C1CCCN1)N1CCC=C(F)C1
InChIInChI=1S/C10H15FN2O/c11-8-3-2-6-13(7-8)10(14)9-4-1-5-12-9/h3,9,12H,1-2,4-7H2
InChIKeyOWSMQGJGNZQNAY-UHFFFAOYSA-N
XLogP0.82
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.24
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone 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 (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone?
The IUPAC name of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone (CID 131091783) is (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone.
What is the SMILES notation for (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone?
The canonical SMILES for (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone is O=C(C1CCCN1)N1CCC=C(F)C1.
What is the InChIKey of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone?
The InChIKey is OWSMQGJGNZQNAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O/c11-8-3-2-6-13(7-8)10(14)9-4-1-5-12-9/h3,9,12H,1-2,4-7H2.
What are the key properties of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone?
(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone has a molecular weight of 198.24 g/mol, XLogP of 0.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-2-ylmethanone is sourced from PubChem (CID 131091783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).