ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate

C14H26N2O3 — CID 63911116

IUPACethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate
SMILESCCOC(=O)C(N)(CN1CCOC(C)(C)C1)C1CC1
InChIInChI=1S/C14H26N2O3/c1-4-18-12(17)14(15,11-5-6-11)10-16-7-8-19-13(2,3)9-16/h11H,4-10,15H2,1-3H3
InChIKeyLLUXXSXIERQCNF-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.77
Rot. Bonds5

About ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate

ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate (PubChem CID 63911116) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate.

Molecular Properties

Compound Nameethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate
PubChem CID63911116
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Nameethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate
SMILESCCOC(=O)C(N)(CN1CCOC(C)(C)C1)C1CC1
InChIInChI=1S/C14H26N2O3/c1-4-18-12(17)14(15,11-5-6-11)10-16-7-8-19-13(2,3)9-16/h11H,4-10,15H2,1-3H3
InChIKeyLLUXXSXIERQCNF-UHFFFAOYSA-N
XLogP0.77
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-amino-2-cyclopropyl-3-(1,4-oxazepan-4-yl)propanoate
CID 63927435
ethyl 2-amino-2-cyclopropyl-3-(2-methylmorpholin-4-yl)propanoate
CID 63907673
ethyl 2-amino-3-(azepan-1-yl)-2-cyclopropylpropanoate
CID 63907466
2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)-2-(ethylamino)propanamide
CID 63911117
ethyl 2-amino-2-cyclopropyl-3-(3-methylpyrrolidin-1-yl)propanoate
CID 63910147
2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanenitrile
CID 63915049
ethyl 4-(2,2-dimethylmorpholin-4-yl)-3-oxobutanoate
CID 63898681
ethyl 2-amino-4-(2,2-dimethylmorpholin-4-yl)-2-methylpentanoate
CID 64711362
2-amino-2-cyclopropyl-3-(3,3,4-trimethylpiperazin-1-yl)propanoic acid
CID 63926025
ethyl 2-amino-2-cyclopropyl-3-(3,4-dihydro-1H-isoquinolin-2-yl)propanoate
CID 63906631
4-(2,2-dimethylmorpholin-4-yl)-2,3,3-trimethylbutan-2-amine
CID 65267178
ethyl 2-amino-2-cyclopropyl-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)propanoate
CID 65301588

Frequently Asked Questions

What is the IUPAC name of ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate?
The IUPAC name of ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate (CID 63911116) is ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate.
What is the SMILES notation for ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate?
The canonical SMILES for ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate is CCOC(=O)C(N)(CN1CCOC(C)(C)C1)C1CC1.
What is the InChIKey of ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate?
The InChIKey is LLUXXSXIERQCNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-4-18-12(17)14(15,11-5-6-11)10-16-7-8-19-13(2,3)9-16/h11H,4-10,15H2,1-3H3.
What are the key properties of ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate?
ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate has a molecular weight of 270.37 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-amino-2-cyclopropyl-3-(2,2-dimethylmorpholin-4-yl)propanoate is sourced from PubChem (CID 63911116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).