(2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride

C7H16ClNO — CID 138040349

IUPAC(2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride
SMILESCO[C@@H]1CCCN[C@@H]1C.Cl
InChIInChI=1S/C7H15NO.ClH/c1-6-7(9-2)4-3-5-8-6;/h6-8H,3-5H2,1-2H3;1H/t6-,7-;/m1./s1
InChIKeySWFVERQPEIMDRX-ZJLYAJKPSA-N
MW165.66 g/mol
LogP1.20
Rot. Bonds1

About (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride

(2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride (PubChem CID 138040349) has the molecular formula C7H16ClNO and a molecular weight of 165.66 g/mol. Its IUPAC name is (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride.

Molecular Properties

Compound Name(2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride
PubChem CID138040349
Molecular FormulaC7H16ClNO
Molecular Weight165.66 g/mol
Exact Mass165.09
IUPAC Name(2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride
SMILESCO[C@@H]1CCCN[C@@H]1C.Cl
InChIInChI=1S/C7H15NO.ClH/c1-6-7(9-2)4-3-5-8-6;/h6-8H,3-5H2,1-2H3;1H/t6-,7-;/m1./s1
InChIKeySWFVERQPEIMDRX-ZJLYAJKPSA-N
XLogP1.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.66
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Methoxypiperidine
CID 4341744
3-Ethoxypiperidine
CID 4341745
3-Propoxypiperidine
CID 4712034
2-Propylmorpholine
CID 20205646
3-(Propan-2-yloxy)piperidine
CID 53409756
3-Methoxypiperidine hydrochloride
CID 23142000
(3R)-3-ethoxypiperidine
CID 40607156
2-(Methoxymethyl)piperidine hydrochloride
CID 45926159
5-Methoxy-2-methylpiperidine
CID 62074269
(3S)-3-methoxypiperidine hydrochloride
CID 67332844
2-Methylpiperidin-3-ol hydrochloride
CID 68440717
rac-(2R,3R)-2-methylpiperidin-3-ol hydrochloride
CID 68443103

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride?
The IUPAC name of (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride (CID 138040349) is (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride.
What is the SMILES notation for (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride?
The canonical SMILES for (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride is CO[C@@H]1CCCN[C@@H]1C.Cl.
What is the InChIKey of (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride?
The InChIKey is SWFVERQPEIMDRX-ZJLYAJKPSA-N. The full InChI is InChI=1S/C7H15NO.ClH/c1-6-7(9-2)4-3-5-8-6;/h6-8H,3-5H2,1-2H3;1H/t6-,7-;/m1./s1.
What are the key properties of (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride?
(2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride has a molecular weight of 165.66 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-3-methoxy-2-methylpiperidine;hydrochloride is sourced from PubChem (CID 138040349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).