3-fluoro-2,5-dimethylpiperidine

C7H14FN — CID 58609151

IUPAC3-fluoro-2,5-dimethylpiperidine
SMILESCC1CNC(C)C(F)C1
InChIInChI=1S/C7H14FN/c1-5-3-7(8)6(2)9-4-5/h5-7,9H,3-4H2,1-2H3
InChIKeyKUUBEOIPERTCDM-UHFFFAOYSA-N
MW131.19 g/mol
LogP1.34
Rot. Bonds

About 3-fluoro-2,5-dimethylpiperidine

3-fluoro-2,5-dimethylpiperidine (PubChem CID 58609151) has the molecular formula C7H14FN and a molecular weight of 131.19 g/mol. Its IUPAC name is 3-fluoro-2,5-dimethylpiperidine.

Molecular Properties

Compound Name3-fluoro-2,5-dimethylpiperidine
PubChem CID58609151
Molecular FormulaC7H14FN
Molecular Weight131.19 g/mol
Exact Mass131.11
IUPAC Name3-fluoro-2,5-dimethylpiperidine
SMILESCC1CNC(C)C(F)C1
InChIInChI=1S/C7H14FN/c1-5-3-7(8)6(2)9-4-5/h5-7,9H,3-4H2,1-2H3
InChIKeyKUUBEOIPERTCDM-UHFFFAOYSA-N
XLogP1.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.19
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-Methylpiperidine
CID 79081
5-Ethyl-2-methylpiperidine
CID 7727
3,5-Dimethylpiperidine
CID 118259
3-Ethylpiperidine
CID 202966
2,3-Dimethylpiperidine
CID 95359
2,5-Dimethylpiperidine
CID 524018
2,4,6-Trimethylpiperidine
CID 89562
2,4-Dimethylpiperidine
CID 95423
3-(Trifluoromethyl)piperidine
CID 2760776
(S)-3-Methylpiperidine
CID 641100
(R)-3-Methylpiperidine
CID 6427444
(S)-3-(Trifluoromethyl)piperidine
CID 7062692

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2,5-dimethylpiperidine?
The IUPAC name of 3-fluoro-2,5-dimethylpiperidine (CID 58609151) is 3-fluoro-2,5-dimethylpiperidine.
What is the SMILES notation for 3-fluoro-2,5-dimethylpiperidine?
The canonical SMILES for 3-fluoro-2,5-dimethylpiperidine is CC1CNC(C)C(F)C1.
What is the InChIKey of 3-fluoro-2,5-dimethylpiperidine?
The InChIKey is KUUBEOIPERTCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FN/c1-5-3-7(8)6(2)9-4-5/h5-7,9H,3-4H2,1-2H3.
What are the key properties of 3-fluoro-2,5-dimethylpiperidine?
3-fluoro-2,5-dimethylpiperidine has a molecular weight of 131.19 g/mol, XLogP of 1.34, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2,5-dimethylpiperidine is sourced from PubChem (CID 58609151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).