4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride

C12H17ClFNO — CID 134691223

IUPAC4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride
SMILESCOc1ccc(C2CCNCC2)c(F)c1.Cl
InChIInChI=1S/C12H16FNO.ClH/c1-15-10-2-3-11(12(13)8-10)9-4-6-14-7-5-9;/h2-3,8-9,14H,4-7H2,1H3;1H
InChIKeyQMMNCZCDHQOJFN-UHFFFAOYSA-N
MW245.72 g/mol
LogP2.72
Rot. Bonds2

About 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride

4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride (PubChem CID 134691223) has the molecular formula C12H17ClFNO and a molecular weight of 245.72 g/mol. Its IUPAC name is 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride.

Molecular Properties

Compound Name4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride
PubChem CID134691223
Molecular FormulaC12H17ClFNO
Molecular Weight245.72 g/mol
Exact Mass245.10
IUPAC Name4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride
SMILESCOc1ccc(C2CCNCC2)c(F)c1.Cl
InChIInChI=1S/C12H16FNO.ClH/c1-15-10-2-3-11(12(13)8-10)9-4-6-14-7-5-9;/h2-3,8-9,14H,4-7H2,1H3;1H
InChIKeyQMMNCZCDHQOJFN-UHFFFAOYSA-N
XLogP2.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.72
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-fluoro-4-(trifluoromethoxy)phenyl]piperidine;hydrochloride
CID 169452686
(2R)-2-(2-fluoro-4-methoxyphenyl)azetidine;hydrochloride
CID 171197142
4-[2-fluoro-4-(2,2,2-trifluoroethoxy)phenyl]piperidine;hydrochloride
CID 134691211
3-(2,4-dimethoxyphenyl)pyrrolidine;hydrochloride
CID 169498250
4-(4-methoxy-2-methylphenyl)azepane
CID 83261173
(2S)-2-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride
CID 171194833
(2R)-2-(2-fluoro-4-methoxyphenyl)piperazine
CID 171194214
N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide;hydrochloride
CID 154814788
3-(4-chloro-2-fluorophenyl)pyrrolidine;hydrochloride
CID 169498278
(2R)-2-(2-fluoro-5-methoxyphenyl)azetidine;hydrochloride
CID 171197365
4-[5-fluoro-2-(4-methoxy-2-methylphenyl)sulfanylphenyl]piperidine
CID 11427529
4-[2-(4-methoxyphenyl)phenyl]piperidine
CID 86226215

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride?
The IUPAC name of 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride (CID 134691223) is 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride.
What is the SMILES notation for 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride?
The canonical SMILES for 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride is COc1ccc(C2CCNCC2)c(F)c1.Cl.
What is the InChIKey of 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride?
The InChIKey is QMMNCZCDHQOJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO.ClH/c1-15-10-2-3-11(12(13)8-10)9-4-6-14-7-5-9;/h2-3,8-9,14H,4-7H2,1H3;1H.
What are the key properties of 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride?
4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride has a molecular weight of 245.72 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride is sourced from PubChem (CID 134691223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).