2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride

C13H25ClN2O3 — CID 118522513

IUPAC2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride
SMILESCC1(C(=O)OCCN2CCOCC2)CCNCC1.Cl
InChIInChI=1S/C13H24N2O3.ClH/c1-13(2-4-14-5-3-13)12(16)18-11-8-15-6-9-17-10-7-15;/h14H,2-11H2,1H3;1H
InChIKeyHVSKAQXWJUKUTK-UHFFFAOYSA-N
MW292.81 g/mol
LogP0.67
Rot. Bonds4

About 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride

2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride (PubChem CID 118522513) has the molecular formula C13H25ClN2O3 and a molecular weight of 292.81 g/mol. Its IUPAC name is 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride.

Molecular Properties

Compound Name2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride
PubChem CID118522513
Molecular FormulaC13H25ClN2O3
Molecular Weight292.81 g/mol
Exact Mass292.16
IUPAC Name2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride
SMILESCC1(C(=O)OCCN2CCOCC2)CCNCC1.Cl
InChIInChI=1S/C13H24N2O3.ClH/c1-13(2-4-14-5-3-13)12(16)18-11-8-15-6-9-17-10-7-15;/h14H,2-11H2,1H3;1H
InChIKeyHVSKAQXWJUKUTK-UHFFFAOYSA-N
XLogP0.67
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride?
The IUPAC name of 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride (CID 118522513) is 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride.
What is the SMILES notation for 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride?
The canonical SMILES for 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride is CC1(C(=O)OCCN2CCOCC2)CCNCC1.Cl.
What is the InChIKey of 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride?
The InChIKey is HVSKAQXWJUKUTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3.ClH/c1-13(2-4-14-5-3-13)12(16)18-11-8-15-6-9-17-10-7-15;/h14H,2-11H2,1H3;1H.
What are the key properties of 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride?
2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride has a molecular weight of 292.81 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride is sourced from PubChem (CID 118522513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).