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

C11H11FN2O — CID 154752021

IUPAC(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)N1CCC=C(F)C1
InChIInChI=1S/C11H11FN2O/c12-9-4-3-7-14(8-9)11(15)10-5-1-2-6-13-10/h1-2,4-6H,3,7-8H2
InChIKeyHBWVASPSFPDQOB-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.78
Rot. Bonds1

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

(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone (PubChem CID 154752021) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone.

Molecular Properties

Compound Name(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone
PubChem CID154752021
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)N1CCC=C(F)C1
InChIInChI=1S/C11H11FN2O/c12-9-4-3-7-14(8-9)11(15)10-5-1-2-6-13-10/h1-2,4-6H,3,7-8H2
InChIKeyHBWVASPSFPDQOB-UHFFFAOYSA-N
XLogP1.78
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(5-fluoro-3,6-dihydro-2H-pyridine-1-carbonyl)pyridine-2-carboxylic acid
CID 120552601
4-(pyridine-2-carbonyl)piperazine-2,6-dione
CID 66085705
(1,1-dioxo-1,4-thiazinan-4-yl)-pyridin-2-ylmethanone
CID 110743458
(1-oxo-1,4-thiazinan-4-yl)-pyridin-2-ylmethanone
CID 110743476
[4-(piperidine-1-carbonyl)piperazin-1-yl]-pyridin-2-ylmethanone
CID 30346280
(2-hydroxyphenyl)-[4-(pyridine-2-carbonyl)piperazin-1-yl]methanone
CID 108534823
[3-(fluoromethyl)azetidin-1-yl]-pyridin-2-ylmethanone
CID 121184939
[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-pyridin-2-ylmethanone
CID 31113719
2-[1-(pyridine-2-carbonyl)piperidin-4-yl]acetic acid
CID 79614951
2-fluoro-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]benzamide
CID 110821143
(3-phenyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-pyridin-2-ylmethanone
CID 134793170
(8-amino-3,4-dihydro-1H-isoquinolin-2-yl)-pyridin-2-ylmethanone
CID 114523309

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone?
The IUPAC name of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone (CID 154752021) is (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone.
What is the SMILES notation for (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone?
The canonical SMILES for (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone is O=C(c1ccccn1)N1CCC=C(F)C1.
What is the InChIKey of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone?
The InChIKey is HBWVASPSFPDQOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c12-9-4-3-7-14(8-9)11(15)10-5-1-2-6-13-10/h1-2,4-6H,3,7-8H2.
What are the key properties of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone?
(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-pyridin-2-ylmethanone has a molecular weight of 206.22 g/mol, XLogP of 1.78, 1 rotatable bonds, 0 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)-pyridin-2-ylmethanone is sourced from PubChem (CID 154752021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).