3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone

C11H14FNO2 — CID 126793064

IUPAC3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESO=C(C1=CCOCC1)N1CCC=C(F)C1
InChIInChI=1S/C11H14FNO2/c12-10-2-1-5-13(8-10)11(14)9-3-6-15-7-4-9/h2-3H,1,4-8H2
InChIKeyIISNCHAVASUWSX-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.42
Rot. Bonds1

About 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone

3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone (PubChem CID 126793064) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone.

Molecular Properties

Compound Name3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone
PubChem CID126793064
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC Name3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESO=C(C1=CCOCC1)N1CCC=C(F)C1
InChIInChI=1S/C11H14FNO2/c12-10-2-1-5-13(8-10)11(14)9-3-6-15-7-4-9/h2-3H,1,4-8H2
InChIKeyIISNCHAVASUWSX-UHFFFAOYSA-N
XLogP1.42
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 126997661
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CID 130675976
CID 130675976
CID 130676019
CID 130676019
CID 130711098
CID 130711098
CID 130875169
CID 130875169
CID 130942292
CID 130942292
CID 131182877
CID 131182877

Frequently Asked Questions

What is the IUPAC name of 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone?
The IUPAC name of 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone (CID 126793064) is 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone.
What is the SMILES notation for 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone?
The canonical SMILES for 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone is O=C(C1=CCOCC1)N1CCC=C(F)C1.
What is the InChIKey of 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone?
The InChIKey is IISNCHAVASUWSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c12-10-2-1-5-13(8-10)11(14)9-3-6-15-7-4-9/h2-3H,1,4-8H2.
What are the key properties of 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone?
3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone has a molecular weight of 211.24 g/mol, XLogP of 1.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dihydro-2H-pyran-4-yl-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methanone is sourced from PubChem (CID 126793064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).