(2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride

C13H20ClNO2 — CID 171195361

IUPAC(2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride
SMILESCOc1ccc([C@H]2CCCCN2)c(OC)c1.Cl
InChIInChI=1S/C13H19NO2.ClH/c1-15-10-6-7-11(13(9-10)16-2)12-5-3-4-8-14-12;/h6-7,9,12,14H,3-5,8H2,1-2H3;1H/t12-;/m1./s1
InChIKeyASECUCVQQCCPFH-UTONKHPSSA-N
MW257.76 g/mol
LogP2.94
Rot. Bonds3

About (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride

(2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride (PubChem CID 171195361) has the molecular formula C13H20ClNO2 and a molecular weight of 257.76 g/mol. Its IUPAC name is (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride.

Molecular Properties

Compound Name(2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride
PubChem CID171195361
Molecular FormulaC13H20ClNO2
Molecular Weight257.76 g/mol
Exact Mass257.12
IUPAC Name(2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride
SMILESCOc1ccc([C@H]2CCCCN2)c(OC)c1.Cl
InChIInChI=1S/C13H19NO2.ClH/c1-15-10-6-7-11(13(9-10)16-2)12-5-3-4-8-14-12;/h6-7,9,12,14H,3-5,8H2,1-2H3;1H/t12-;/m1./s1
InChIKeyASECUCVQQCCPFH-UTONKHPSSA-N
XLogP2.94
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.76
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(2,4-dimethoxyphenyl)piperidine
CID 7022848
(2S)-2-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride
CID 171194833
2-(2-bromo-4-methoxyphenyl)piperidine
CID 82625568
(2S)-2-(4-methoxy-2-methylphenyl)azepane
CID 26189003
(2S)-2-(4-fluoro-2-methoxyphenyl)piperidine
CID 96773994
(2R)-2-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrrolidine
CID 171196183
(2S)-2-[2-methoxy-4-(trifluoromethyl)phenyl]piperidine;hydrochloride
CID 171195272
4-methoxy-2-[(2R)-piperidin-2-yl]phenol
CID 131513044
5-methoxy-2-[(2R)-pyrrolidin-2-yl]phenol;hydrochloride
CID 171195842
(2R)-2-(2,4-dimethoxyphenyl)piperazine;hydrochloride
CID 171194245
4-methoxy-2-[(2S)-piperidin-2-yl]phenol
CID 131531573
2-(2,4,5-trimethoxyphenyl)azepane
CID 62543409

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride?
The IUPAC name of (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride (CID 171195361) is (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride.
What is the SMILES notation for (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride?
The canonical SMILES for (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride is COc1ccc([C@H]2CCCCN2)c(OC)c1.Cl.
What is the InChIKey of (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride?
The InChIKey is ASECUCVQQCCPFH-UTONKHPSSA-N. The full InChI is InChI=1S/C13H19NO2.ClH/c1-15-10-6-7-11(13(9-10)16-2)12-5-3-4-8-14-12;/h6-7,9,12,14H,3-5,8H2,1-2H3;1H/t12-;/m1./s1.
What are the key properties of (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride?
(2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride has a molecular weight of 257.76 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride is sourced from PubChem (CID 171195361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).