methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride

C10H19ClN2O4 — CID 119768677

IUPACmethyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride
SMILESCOC(=O)C(C)CNC(=O)C1CNCCO1.Cl
InChIInChI=1S/C10H18N2O4.ClH/c1-7(10(14)15-2)5-12-9(13)8-6-11-3-4-16-8;/h7-8,11H,3-6H2,1-2H3,(H,12,13);1H
InChIKeyJYOWFXSYLUJBOJ-UHFFFAOYSA-N
MW266.72 g/mol
LogP-0.68
Rot. Bonds4

About methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride

methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride (PubChem CID 119768677) has the molecular formula C10H19ClN2O4 and a molecular weight of 266.72 g/mol. Its IUPAC name is methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride.

Molecular Properties

Compound Namemethyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride
PubChem CID119768677
Molecular FormulaC10H19ClN2O4
Molecular Weight266.72 g/mol
Exact Mass266.10
IUPAC Namemethyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride
SMILESCOC(=O)C(C)CNC(=O)C1CNCCO1.Cl
InChIInChI=1S/C10H18N2O4.ClH/c1-7(10(14)15-2)5-12-9(13)8-6-11-3-4-16-8;/h7-8,11H,3-6H2,1-2H3,(H,12,13);1H
InChIKeyJYOWFXSYLUJBOJ-UHFFFAOYSA-N
XLogP-0.68
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.72
LogP ≤ 5-0.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-N-(2-aminopropyl)morpholine-2-carboxamide;hydrochloride
CID 130680040
methyl (2R)-2-(morpholine-2-carbonylamino)propanoate
CID 119781299
N-(2-morpholin-4-ylpropyl)morpholine-2-carboxamide;dihydrochloride
CID 119849919
N-(2-morpholin-4-ylpropyl)morpholine-2-carboxamide
CID 119849920
N-[2-(4-methylpiperidin-1-yl)propyl]morpholine-2-carboxamide;dihydrochloride
CID 119866591
N-[2-[methyl(propan-2-yl)amino]ethyl]morpholine-2-carboxamide
CID 62641152
N-[2-(4-fluorophenoxy)propyl]morpholine-2-carboxamide
CID 119804499
(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride
CID 130702713
(2S)-N-(cyclobutylmethyl)morpholine-2-carboxamide;hydrochloride
CID 131065842
N-[2-(2,6-dichlorophenyl)propyl]morpholine-2-carboxamide
CID 119768768
2-(morpholine-2-carbonylamino)ethyl carbamate
CID 83210560
N-[2-(3-chlorophenoxy)propyl]morpholine-2-carboxamide;hydrochloride
CID 119807139

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride?
The IUPAC name of methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride (CID 119768677) is methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride.
What is the SMILES notation for methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride?
The canonical SMILES for methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride is COC(=O)C(C)CNC(=O)C1CNCCO1.Cl.
What is the InChIKey of methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride?
The InChIKey is JYOWFXSYLUJBOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4.ClH/c1-7(10(14)15-2)5-12-9(13)8-6-11-3-4-16-8;/h7-8,11H,3-6H2,1-2H3,(H,12,13);1H.
What are the key properties of methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride?
methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride has a molecular weight of 266.72 g/mol, XLogP of -0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-3-(morpholine-2-carbonylamino)propanoate;hydrochloride is sourced from PubChem (CID 119768677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).