ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate

C14H24N2O5 — CID 61013053

IUPACethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate
SMILESCCOC(=O)CN(CC)C(=O)C1CC(=O)N(CCOC)C1
InChIInChI=1S/C14H24N2O5/c1-4-15(10-13(18)21-5-2)14(19)11-8-12(17)16(9-11)6-7-20-3/h11H,4-10H2,1-3H3
InChIKeyVWCAZRDUGKXXNC-UHFFFAOYSA-N
MW300.36 g/mol
LogP-0.11
Rot. Bonds8

About ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate

ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate (PubChem CID 61013053) has the molecular formula C14H24N2O5 and a molecular weight of 300.36 g/mol. Its IUPAC name is ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate
PubChem CID61013053
Molecular FormulaC14H24N2O5
Molecular Weight300.36 g/mol
Exact Mass300.17
IUPAC Nameethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate
SMILESCCOC(=O)CN(CC)C(=O)C1CC(=O)N(CCOC)C1
InChIInChI=1S/C14H24N2O5/c1-4-15(10-13(18)21-5-2)14(19)11-8-12(17)16(9-11)6-7-20-3/h11H,4-10H2,1-3H3
InChIKeyVWCAZRDUGKXXNC-UHFFFAOYSA-N
XLogP-0.11
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 5-0.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate?
The IUPAC name of ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate (CID 61013053) is ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate.
What is the SMILES notation for ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate?
The canonical SMILES for ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate is CCOC(=O)CN(CC)C(=O)C1CC(=O)N(CCOC)C1.
What is the InChIKey of ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate?
The InChIKey is VWCAZRDUGKXXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O5/c1-4-15(10-13(18)21-5-2)14(19)11-8-12(17)16(9-11)6-7-20-3/h11H,4-10H2,1-3H3.
What are the key properties of ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate?
ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate has a molecular weight of 300.36 g/mol, XLogP of -0.11, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[ethyl-[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]acetate is sourced from PubChem (CID 61013053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).