2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid

C9H15NO5 — CID 83228998

IUPAC2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid
SMILESO=C(O)COCC(=O)NOC1CCCC1
InChIInChI=1S/C9H15NO5/c11-8(5-14-6-9(12)13)10-15-7-3-1-2-4-7/h7H,1-6H2,(H,10,11)(H,12,13)
InChIKeyQZKMHFGGIKDNKS-UHFFFAOYSA-N
MW217.22 g/mol
LogP0.08
Rot. Bonds6

About 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid

2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid (PubChem CID 83228998) has the molecular formula C9H15NO5 and a molecular weight of 217.22 g/mol. Its IUPAC name is 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid.

Molecular Properties

Compound Name2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid
PubChem CID83228998
Molecular FormulaC9H15NO5
Molecular Weight217.22 g/mol
Exact Mass217.10
IUPAC Name2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid
SMILESO=C(O)COCC(=O)NOC1CCCC1
InChIInChI=1S/C9H15NO5/c11-8(5-14-6-9(12)13)10-15-7-3-1-2-4-7/h7H,1-6H2,(H,10,11)(H,12,13)
InChIKeyQZKMHFGGIKDNKS-UHFFFAOYSA-N
XLogP0.08
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.22
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopentyloxy-2-phenylmethoxyacetamide
CID 83202202
2-[2-(2-cyclopentyloxyethylcarbamoylamino)-2-oxoethoxy]acetic acid
CID 63828865
N-cyclopentyloxy-2-(cyclopropylmethylamino)acetamide
CID 83235393
N-cyclopentyloxy-2-phenylacetamide
CID 83202949
N-cyclopentyloxy-4,4,4-trifluorobutanamide
CID 83202760
cyclobutyloxycarbamic acid
CID 87192144
2-[2-(4-cyclohexylbutan-2-ylamino)-2-oxoethoxy]acetic acid
CID 20558858
2-[2-[[2-(hydroxymethyl)cyclohexyl]amino]-2-oxoethoxy]acetic acid
CID 106359300
2-cyclododecyloxyacetic acid
CID 19371812
2-cycloheptyloxyacetic acid
CID 61069533
2-(1-aminocyclohexyl)-N-cyclopentyloxyacetamide
CID 83236332
N-[2-(cyclopentyloxyamino)-2-oxoethyl]-2,2-dimethylpropanamide
CID 83201783

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid?
The IUPAC name of 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid (CID 83228998) is 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid.
What is the SMILES notation for 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid?
The canonical SMILES for 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid is O=C(O)COCC(=O)NOC1CCCC1.
What is the InChIKey of 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid?
The InChIKey is QZKMHFGGIKDNKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO5/c11-8(5-14-6-9(12)13)10-15-7-3-1-2-4-7/h7H,1-6H2,(H,10,11)(H,12,13).
What are the key properties of 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid?
2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid has a molecular weight of 217.22 g/mol, XLogP of 0.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopentyloxyamino)-2-oxoethoxy]acetic acid is sourced from PubChem (CID 83228998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).