(3-fluoropiperidin-1-yl)-phenylmethanone

C12H14FNO — CID 167717341

IUPAC(3-fluoropiperidin-1-yl)-phenylmethanone
SMILESO=C(c1ccccc1)N1CCCC(F)C1
InChIInChI=1S/C12H14FNO/c13-11-7-4-8-14(9-11)12(15)10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2
InChIKeyRJBUEQITCHEOKZ-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.26
Rot. Bonds1

About (3-fluoropiperidin-1-yl)-phenylmethanone

(3-fluoropiperidin-1-yl)-phenylmethanone (PubChem CID 167717341) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is (3-fluoropiperidin-1-yl)-phenylmethanone.

Molecular Properties

Compound Name(3-fluoropiperidin-1-yl)-phenylmethanone
PubChem CID167717341
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name(3-fluoropiperidin-1-yl)-phenylmethanone
SMILESO=C(c1ccccc1)N1CCCC(F)C1
InChIInChI=1S/C12H14FNO/c13-11-7-4-8-14(9-11)12(15)10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2
InChIKeyRJBUEQITCHEOKZ-UHFFFAOYSA-N
XLogP2.26
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-benzoylpiperidine-3-carbonyl chloride
CID 15718173
(5-hydroxyazocan-1-yl)-phenylmethanone
CID 165346872
1-benzoylpiperidine-3-sulfonyl chloride
CID 75480400
(3,4-dimethylpiperidin-1-yl)-phenylmethanone
CID 115871745
phenyl-(3-phenylpyrrolidin-1-yl)methanone
CID 6422044
(3-fluoropyrrolidin-1-yl)-(4-iodophenyl)methanone
CID 170122418
sodium 1-benzoylpiperidine-3-sulfinate
CID 165454380
phenyl-(3-pyrrolidin-1-ylsulfonylpiperidin-1-yl)methanone
CID 75474346
[(3S)-3-(4-fluoroanilino)piperidin-1-yl]-phenylmethanone
CID 25449307
4-amino-1-benzoylazepane-3-carbaldehyde
CID 174444263
(3S)-1-benzoylpyrrolidine-3-carboxylic acid
CID 92614961
[(3aR,6aS)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-phenylmethanone
CID 15855718

Frequently Asked Questions

What is the IUPAC name of (3-fluoropiperidin-1-yl)-phenylmethanone?
The IUPAC name of (3-fluoropiperidin-1-yl)-phenylmethanone (CID 167717341) is (3-fluoropiperidin-1-yl)-phenylmethanone.
What is the SMILES notation for (3-fluoropiperidin-1-yl)-phenylmethanone?
The canonical SMILES for (3-fluoropiperidin-1-yl)-phenylmethanone is O=C(c1ccccc1)N1CCCC(F)C1.
What is the InChIKey of (3-fluoropiperidin-1-yl)-phenylmethanone?
The InChIKey is RJBUEQITCHEOKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c13-11-7-4-8-14(9-11)12(15)10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2.
What are the key properties of (3-fluoropiperidin-1-yl)-phenylmethanone?
(3-fluoropiperidin-1-yl)-phenylmethanone has a molecular weight of 207.25 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoropiperidin-1-yl)-phenylmethanone is sourced from PubChem (CID 167717341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).