2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid

C11H19NO4 — CID 64973986

IUPAC2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid
SMILESCCONC(=O)CC1(CC(=O)O)CCCC1
InChIInChI=1S/C11H19NO4/c1-2-16-12-9(13)7-11(8-10(14)15)5-3-4-6-11/h2-8H2,1H3,(H,12,13)(H,14,15)
InChIKeyWBFHLTAKAQXTST-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.48
Rot. Bonds6

About 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid

2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid (PubChem CID 64973986) has the molecular formula C11H19NO4 and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid
PubChem CID64973986
Molecular FormulaC11H19NO4
Molecular Weight229.28 g/mol
Exact Mass229.13
IUPAC Name2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid
SMILESCCONC(=O)CC1(CC(=O)O)CCCC1
InChIInChI=1S/C11H19NO4/c1-2-16-12-9(13)7-11(8-10(14)15)5-3-4-6-11/h2-8H2,1H3,(H,12,13)(H,14,15)
InChIKeyWBFHLTAKAQXTST-UHFFFAOYSA-N
XLogP1.48
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid (CID 64973986) is 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid is CCONC(=O)CC1(CC(=O)O)CCCC1.
What is the InChIKey of 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid?
The InChIKey is WBFHLTAKAQXTST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO4/c1-2-16-12-9(13)7-11(8-10(14)15)5-3-4-6-11/h2-8H2,1H3,(H,12,13)(H,14,15).
What are the key properties of 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid?
2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid has a molecular weight of 229.28 g/mol, XLogP of 1.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(ethoxyamino)-2-oxoethyl]cyclopentyl]acetic acid is sourced from PubChem (CID 64973986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).