methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate

C14H24N2O4 — CID 79822357

IUPACmethyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate
SMILESCCN(C(=O)CN1CCOC(CC(=O)OC)C1)C1CC1
InChIInChI=1S/C14H24N2O4/c1-3-16(11-4-5-11)13(17)10-15-6-7-20-12(9-15)8-14(18)19-2/h11-12H,3-10H2,1-2H3
InChIKeyFAAQRPJVSOHDBF-UHFFFAOYSA-N
MW284.36 g/mol
LogP0.26
Rot. Bonds6

About methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate

methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate (PubChem CID 79822357) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate
PubChem CID79822357
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Namemethyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate
SMILESCCN(C(=O)CN1CCOC(CC(=O)OC)C1)C1CC1
InChIInChI=1S/C14H24N2O4/c1-3-16(11-4-5-11)13(17)10-15-6-7-20-12(9-15)8-14(18)19-2/h11-12H,3-10H2,1-2H3
InChIKeyFAAQRPJVSOHDBF-UHFFFAOYSA-N
XLogP0.26
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 50.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate?
The IUPAC name of methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate (CID 79822357) is methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate.
What is the SMILES notation for methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate?
The canonical SMILES for methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate is CCN(C(=O)CN1CCOC(CC(=O)OC)C1)C1CC1.
What is the InChIKey of methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate?
The InChIKey is FAAQRPJVSOHDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-3-16(11-4-5-11)13(17)10-15-6-7-20-12(9-15)8-14(18)19-2/h11-12H,3-10H2,1-2H3.
What are the key properties of methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate?
methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate has a molecular weight of 284.36 g/mol, XLogP of 0.26, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate is sourced from PubChem (CID 79822357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).