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

C11H12FNO2 — CID 167784706

IUPAC1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone
SMILESO=C(Cc1ccco1)N1CCC=C(F)C1
InChIInChI=1S/C11H12FNO2/c12-9-3-1-5-13(8-9)11(14)7-10-4-2-6-15-10/h2-4,6H,1,5,7-8H2
InChIKeySRVUPGRLZXNDOT-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.91
Rot. Bonds2

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

1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone (PubChem CID 167784706) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone.

Molecular Properties

Compound Name1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone
PubChem CID167784706
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC Name1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone
SMILESO=C(Cc1ccco1)N1CCC=C(F)C1
InChIInChI=1S/C11H12FNO2/c12-9-3-1-5-13(8-9)11(14)7-10-4-2-6-15-10/h2-4,6H,1,5,7-8H2
InChIKeySRVUPGRLZXNDOT-UHFFFAOYSA-N
XLogP1.91
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-aminopyrrolidin-1-yl)-2-(furan-2-yl)ethanone
CID 83619262
2-(furan-2-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone
CID 110690646
4-[1-[2-(furan-2-yl)acetyl]piperidin-4-yl]benzenesulfonamide
CID 138024921
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-2-(furan-2-yl)ethanone
CID 83172966
ethyl 1-[2-(furan-2-yl)acetyl]piperidine-3-carboxylate
CID 110690641
1-cyclopropyl-2-(furan-2-yl)ethanone
CID 83172331
3-(furan-2-yl)-1,1-diphenylpropan-2-one
CID 83171492
1-(4-fluorophenyl)-2-(furan-2-yl)ethanone
CID 83172698
2-(2-bromophenyl)-1-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanone
CID 113073906
2-(furan-2-yl)-1-(5-oxa-9-azaspiro[3.5]nonan-9-yl)ethanone
CID 136570966
1-[(5aS,8aR)-4-methylsulfonyl-3,5,5a,6,8,8a-hexahydro-2H-pyrrolo[3,4-f][1,4]oxazepin-7-yl]-2-(furan-2-yl)ethanone
CID 124783385
1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(furan-2-ylmethylsulfanyl)ethanone
CID 78812589

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone?
The IUPAC name of 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone (CID 167784706) is 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone.
What is the SMILES notation for 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone?
The canonical SMILES for 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone is O=C(Cc1ccco1)N1CCC=C(F)C1.
What is the InChIKey of 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone?
The InChIKey is SRVUPGRLZXNDOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c12-9-3-1-5-13(8-9)11(14)7-10-4-2-6-15-10/h2-4,6H,1,5,7-8H2.
What are the key properties of 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone?
1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone has a molecular weight of 209.22 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanone is sourced from PubChem (CID 167784706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).