ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate

C13H26N2O3 — CID 62027191

IUPACethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate
SMILESCCOC(=O)CN(CCN1CCOCC1)C(C)C
InChIInChI=1S/C13H26N2O3/c1-4-18-13(16)11-15(12(2)3)6-5-14-7-9-17-10-8-14/h12H,4-11H2,1-3H3
InChIKeyLCZPYOOKSVHUFE-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.59
Rot. Bonds7

About ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate

ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate (PubChem CID 62027191) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate
PubChem CID62027191
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Nameethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate
SMILESCCOC(=O)CN(CCN1CCOCC1)C(C)C
InChIInChI=1S/C13H26N2O3/c1-4-18-13(16)11-15(12(2)3)6-5-14-7-9-17-10-8-14/h12H,4-11H2,1-3H3
InChIKeyLCZPYOOKSVHUFE-UHFFFAOYSA-N
XLogP0.59
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-[2-piperidin-1-ylethyl(propan-2-yl)amino]acetate
CID 62027944
ethyl (2R)-2-[methyl(2-morpholin-4-ylethyl)amino]propanoate
CID 95623746
ethyl 2-[morpholin-4-ylsulfonyl(propan-2-yl)amino]acetate
CID 51087618
ethyl 7-morpholin-4-ylheptanoate
CID 56691255
ethyl 7-morpholin-4-ylheptanoate;hydrochloride
CID 71385589
ethyl 2-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]propanoate;hydrobromide
CID 160558993
ethyl 2-[[2-(azepan-1-yl)-2-oxoethyl]-propan-2-ylamino]acetate
CID 61224895
methyl 2-[ethyl(2-morpholin-4-ylethyl)amino]acetate
CID 55207196
ethyl acetate;4-propylmorpholine
CID 160534633
2-ethoxycarbonyl-4-morpholin-4-ylbutanoic acid
CID 103973536
2-amino-N-methyl-N-(2-morpholin-4-ylethyl)propanamide
CID 83534311
ethyl 2-[2-[(2-methylpropan-2-yl)oxy]ethyl-propan-2-ylamino]acetate
CID 112687535

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate?
The IUPAC name of ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate (CID 62027191) is ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate.
What is the SMILES notation for ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate?
The canonical SMILES for ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate is CCOC(=O)CN(CCN1CCOCC1)C(C)C.
What is the InChIKey of ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate?
The InChIKey is LCZPYOOKSVHUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-4-18-13(16)11-15(12(2)3)6-5-14-7-9-17-10-8-14/h12H,4-11H2,1-3H3.
What are the key properties of ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate?
ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate has a molecular weight of 258.36 g/mol, XLogP of 0.59, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-morpholin-4-ylethyl(propan-2-yl)amino]acetate is sourced from PubChem (CID 62027191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).