1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine

C14H19F2N — CID 155721139

IUPAC1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine
SMILESCC1CCCCN1CCc1cc(F)ccc1F
InChIInChI=1S/C14H19F2N/c1-11-4-2-3-8-17(11)9-7-12-10-13(15)5-6-14(12)16/h5-6,10-11H,2-4,7-9H2,1H3
InChIKeyNPIMJXQSKVAINA-UHFFFAOYSA-N
MW239.31 g/mol
LogP3.38
Rot. Bonds3

About 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine

1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine (PubChem CID 155721139) has the molecular formula C14H19F2N and a molecular weight of 239.31 g/mol. Its IUPAC name is 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine.

Molecular Properties

Compound Name1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine
PubChem CID155721139
Molecular FormulaC14H19F2N
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC Name1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine
SMILESCC1CCCCN1CCc1cc(F)ccc1F
InChIInChI=1S/C14H19F2N/c1-11-4-2-3-8-17(11)9-7-12-10-13(15)5-6-14(12)16/h5-6,10-11H,2-4,7-9H2,1H3
InChIKeyNPIMJXQSKVAINA-UHFFFAOYSA-N
XLogP3.38
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-1-[2-(2-chloro-4-fluorophenyl)ethyl]-2-methylpiperidine
CID 176781027
1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol
CID 82217054
1-[2-(2-methoxyphenyl)ethyl]-2-methylpyrrolidine
CID 75030496
[2-[2-(2-methylazepan-1-yl)ethyl]phenyl]methanamine
CID 81321986
N-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 16554820
1-[2-(2-bromo-5-methoxyphenyl)ethyl]-2-methylpiperidine
CID 171934524
1-[1-[(2,5-difluorophenyl)methyl]piperidin-2-yl]-N-methylethanamine
CID 63852929
2-[[4-fluoro-2-[(2-methylpiperidin-1-yl)methyl]phenyl]methylideneamino]guanidine
CID 168590664
1-[(2,5-difluorophenyl)methyl]piperidine-2-carboxylic acid
CID 3500116
1-[1-[(2,5-difluorophenyl)methyl]azepan-2-yl]propan-2-one
CID 79559683
N-[(3,4-difluorophenyl)methyl]-3-(2-methylpiperidin-1-yl)propan-1-amine
CID 43178246
1-[(2,5-difluorophenyl)methyl]azepane-2-carboxylic acid
CID 64563952

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine?
The IUPAC name of 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine (CID 155721139) is 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine.
What is the SMILES notation for 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine?
The canonical SMILES for 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine is CC1CCCCN1CCc1cc(F)ccc1F.
What is the InChIKey of 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine?
The InChIKey is NPIMJXQSKVAINA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N/c1-11-4-2-3-8-17(11)9-7-12-10-13(15)5-6-14(12)16/h5-6,10-11H,2-4,7-9H2,1H3.
What are the key properties of 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine?
1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine has a molecular weight of 239.31 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine is sourced from PubChem (CID 155721139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).