methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate

C14H26N2O3 — CID 63908889

IUPACmethyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate
SMILESCCC1COC(C)CN1CC(N)(C(=O)OC)C1CC1
InChIInChI=1S/C14H26N2O3/c1-4-12-8-19-10(2)7-16(12)9-14(15,11-5-6-11)13(17)18-3/h10-12H,4-9,15H2,1-3H3
InChIKeyONFALFPRANHYCI-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.77
Rot. Bonds5

About methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate

methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate (PubChem CID 63908889) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate.

Molecular Properties

Compound Namemethyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate
PubChem CID63908889
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Namemethyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate
SMILESCCC1COC(C)CN1CC(N)(C(=O)OC)C1CC1
InChIInChI=1S/C14H26N2O3/c1-4-12-8-19-10(2)7-16(12)9-14(15,11-5-6-11)13(17)18-3/h10-12H,4-9,15H2,1-3H3
InChIKeyONFALFPRANHYCI-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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Frequently Asked Questions

What is the IUPAC name of methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate?
The IUPAC name of methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate (CID 63908889) is methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate.
What is the SMILES notation for methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate?
The canonical SMILES for methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate is CCC1COC(C)CN1CC(N)(C(=O)OC)C1CC1.
What is the InChIKey of methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate?
The InChIKey is ONFALFPRANHYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-4-12-8-19-10(2)7-16(12)9-14(15,11-5-6-11)13(17)18-3/h10-12H,4-9,15H2,1-3H3.
What are the key properties of methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate?
methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-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 methyl 2-amino-2-cyclopropyl-3-(5-ethyl-2-methylmorpholin-4-yl)propanoate is sourced from PubChem (CID 63908889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).