2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone

C14H18FNO — CID 127119816

IUPAC2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone
SMILESCC1CCCCN1C(=O)Cc1ccccc1F
InChIInChI=1S/C14H18FNO/c1-11-6-4-5-9-16(11)14(17)10-12-7-2-3-8-13(12)15/h2-3,7-8,11H,4-6,9-10H2,1H3
InChIKeyWXXGVSXGSOZIFA-UHFFFAOYSA-N
MW235.30 g/mol
LogP2.77
Rot. Bonds2

About 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone

2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone (PubChem CID 127119816) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone
PubChem CID127119816
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone
SMILESCC1CCCCN1C(=O)Cc1ccccc1F
InChIInChI=1S/C14H18FNO/c1-11-6-4-5-9-16(11)14(17)10-12-7-2-3-8-13(12)15/h2-3,7-8,11H,4-6,9-10H2,1H3
InChIKeyWXXGVSXGSOZIFA-UHFFFAOYSA-N
XLogP2.77
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(aminomethyl)phenyl]-1-(2-methylazepan-1-yl)ethanone
CID 81322400
2-[4-[2-(2-fluorophenyl)ethyl]piperazin-1-yl]-1-[(2R)-2-methylpiperidin-1-yl]ethanone
CID 99642062
2-(2-chloro-6-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone
CID 25252634
2-(2-methylphenyl)-1-(2-methylpyrrolidin-1-yl)ethanone
CID 110728198
1-(2,4-dimethylpiperazin-1-yl)-2-(2-fluorophenyl)ethanone
CID 110707809
1-(2-ethylpyrrolidin-1-yl)-2-(2-fluorophenyl)ethanone
CID 110671110
N-[(2-fluorophenyl)methyl]-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]acetamide
CID 134045272
2-(2-ethoxyphenyl)-1-[(2R)-2-methylpiperidin-1-yl]ethanone
CID 134503396
1-[2-(chloromethyl)pyrrolidin-1-yl]-2-(2-fluorophenyl)ethanone
CID 55187621
2-(2-bromo-4-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone
CID 170456761
3-(2-chlorophenyl)-1-(2-methylpiperidin-1-yl)propan-1-one
CID 78785123
2-(4-hydroxyphenyl)-1-(2-methylpiperidin-1-yl)ethanone
CID 110465878

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone?
The IUPAC name of 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone (CID 127119816) is 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone is CC1CCCCN1C(=O)Cc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone?
The InChIKey is WXXGVSXGSOZIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-11-6-4-5-9-16(11)14(17)10-12-7-2-3-8-13(12)15/h2-3,7-8,11H,4-6,9-10H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone?
2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone has a molecular weight of 235.30 g/mol, XLogP of 2.77, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-1-(2-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 127119816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).