ethyl morpholine-2-carboxylate;dihydrochloride

C7H15Cl2NO3 — CID 127258967

IUPACethyl morpholine-2-carboxylate;dihydrochloride
SMILESCCOC(=O)C1CNCCO1.Cl.Cl
InChIInChI=1S/C7H13NO3.2ClH/c1-2-10-7(9)6-5-8-3-4-11-6;;/h6,8H,2-5H2,1H3;2*1H
InChIKeySFFPLRWDYFBMSY-UHFFFAOYSA-N
MW232.11 g/mol
LogP0.38
Rot. Bonds2

About ethyl morpholine-2-carboxylate;dihydrochloride

ethyl morpholine-2-carboxylate;dihydrochloride (PubChem CID 127258967) has the molecular formula C7H15Cl2NO3 and a molecular weight of 232.11 g/mol. Its IUPAC name is ethyl morpholine-2-carboxylate;dihydrochloride.

Molecular Properties

Compound Nameethyl morpholine-2-carboxylate;dihydrochloride
PubChem CID127258967
Molecular FormulaC7H15Cl2NO3
Molecular Weight232.11 g/mol
Exact Mass231.04
IUPAC Nameethyl morpholine-2-carboxylate;dihydrochloride
SMILESCCOC(=O)C1CNCCO1.Cl.Cl
InChIInChI=1S/C7H13NO3.2ClH/c1-2-10-7(9)6-5-8-3-4-11-6;;/h6,8H,2-5H2,1H3;2*1H
InChIKeySFFPLRWDYFBMSY-UHFFFAOYSA-N
XLogP0.38
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.11
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

cyclohexylmethyl morpholine-2-carboxylate
CID 62382529
ethyl 3-[(2S)-morpholin-2-yl]propanoate
CID 118409650
(2R)-morpholine-2-carboxamide
CID 51600069
N-[methoxy(dimethyl)silyl]-N-methylmorpholine-2-carboxamide
CID 69339522
ethane;1-morpholin-2-ylethanone
CID 143224838
ethane;morpholine-2-carboxylic acid
CID 170608685
N,N-dimethylmorpholine-2-carboxamide;hydrochloride
CID 71298970
cyclobutyl morpholine-2-carboxylate
CID 62217575
ethyl (2S)-5-methylmorpholine-2-carboxylate
CID 155291522
triethyl 2-[(2S)-morpholin-2-yl]ethane-1,1,1-tricarboxylate
CID 165157175
1-morpholin-2-ylhexadecan-1-one
CID 70404670
1-morpholin-2-yloctan-1-one
CID 70601940

Frequently Asked Questions

What is the IUPAC name of ethyl morpholine-2-carboxylate;dihydrochloride?
The IUPAC name of ethyl morpholine-2-carboxylate;dihydrochloride (CID 127258967) is ethyl morpholine-2-carboxylate;dihydrochloride.
What is the SMILES notation for ethyl morpholine-2-carboxylate;dihydrochloride?
The canonical SMILES for ethyl morpholine-2-carboxylate;dihydrochloride is CCOC(=O)C1CNCCO1.Cl.Cl.
What is the InChIKey of ethyl morpholine-2-carboxylate;dihydrochloride?
The InChIKey is SFFPLRWDYFBMSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3.2ClH/c1-2-10-7(9)6-5-8-3-4-11-6;;/h6,8H,2-5H2,1H3;2*1H.
What are the key properties of ethyl morpholine-2-carboxylate;dihydrochloride?
ethyl morpholine-2-carboxylate;dihydrochloride has a molecular weight of 232.11 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl morpholine-2-carboxylate;dihydrochloride is sourced from PubChem (CID 127258967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).