4-fluoro-4-(2-methylphenyl)piperidine

C12H16FN — CID 69232265

IUPAC4-fluoro-4-(2-methylphenyl)piperidine
SMILESCc1ccccc1C1(F)CCNCC1
InChIInChI=1S/C12H16FN/c1-10-4-2-3-5-11(10)12(13)6-8-14-9-7-12/h2-5,14H,6-9H2,1H3
InChIKeyRKUVNQATVJKHPC-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.54
Rot. Bonds1

About 4-fluoro-4-(2-methylphenyl)piperidine

4-fluoro-4-(2-methylphenyl)piperidine (PubChem CID 69232265) has the molecular formula C12H16FN and a molecular weight of 193.27 g/mol. Its IUPAC name is 4-fluoro-4-(2-methylphenyl)piperidine.

Molecular Properties

Compound Name4-fluoro-4-(2-methylphenyl)piperidine
PubChem CID69232265
Molecular FormulaC12H16FN
Molecular Weight193.27 g/mol
Exact Mass193.13
IUPAC Name4-fluoro-4-(2-methylphenyl)piperidine
SMILESCc1ccccc1C1(F)CCNCC1
InChIInChI=1S/C12H16FN/c1-10-4-2-3-5-11(10)12(13)6-8-14-9-7-12/h2-5,14H,6-9H2,1H3
InChIKeyRKUVNQATVJKHPC-UHFFFAOYSA-N
XLogP2.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3S)-3-fluoro-3-(2-methylphenyl)pyrrolidine
CID 98774589
3-fluoro-3-(2-methylphenyl)piperidine
CID 83818332
4-(2,5-dimethylphenyl)-4-fluoropiperidine
CID 112563134
4-(2-methylphenyl)piperidin-4-amine
CID 70261882
4-fluoro-4-(2,4,5-trimethylphenyl)piperidine
CID 112563237
4-fluoro-4-[2-(trifluoromethyl)phenyl]piperidine
CID 91662828
2-(3-fluoropyrrolidin-3-yl)aniline
CID 105438750
4-(2-cyclobutylphenyl)-4-fluoropiperidine
CID 114607386
1-[4-(2-methylphenyl)piperidin-4-yl]propan-1-one
CID 82289312
3-fluoro-3-(2-methylphenyl)cyclopentan-1-amine
CID 112565649
3,3-difluoro-2-methyl-2-(2-methylphenyl)piperidine;hydrochloride
CID 115048909
ethane;spiro[1H-2-benzofuran-3,4'-piperidine]
CID 163403209

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-4-(2-methylphenyl)piperidine?
The IUPAC name of 4-fluoro-4-(2-methylphenyl)piperidine (CID 69232265) is 4-fluoro-4-(2-methylphenyl)piperidine.
What is the SMILES notation for 4-fluoro-4-(2-methylphenyl)piperidine?
The canonical SMILES for 4-fluoro-4-(2-methylphenyl)piperidine is Cc1ccccc1C1(F)CCNCC1.
What is the InChIKey of 4-fluoro-4-(2-methylphenyl)piperidine?
The InChIKey is RKUVNQATVJKHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-10-4-2-3-5-11(10)12(13)6-8-14-9-7-12/h2-5,14H,6-9H2,1H3.
What are the key properties of 4-fluoro-4-(2-methylphenyl)piperidine?
4-fluoro-4-(2-methylphenyl)piperidine has a molecular weight of 193.27 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-4-(2-methylphenyl)piperidine is sourced from PubChem (CID 69232265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).