2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid

C12H21NO5 — CID 64673171

IUPAC2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid
SMILESCOCCOCC(=O)NC1(CC(=O)O)CCCC1
InChIInChI=1S/C12H21NO5/c1-17-6-7-18-9-10(14)13-12(8-11(15)16)4-2-3-5-12/h2-9H2,1H3,(H,13,14)(H,15,16)
InChIKeyFZCQILWNYWMBFQ-UHFFFAOYSA-N
MW259.30 g/mol
LogP0.55
Rot. Bonds8

About 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid

2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid (PubChem CID 64673171) has the molecular formula C12H21NO5 and a molecular weight of 259.30 g/mol. Its IUPAC name is 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid
PubChem CID64673171
Molecular FormulaC12H21NO5
Molecular Weight259.30 g/mol
Exact Mass259.14
IUPAC Name2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid
SMILESCOCCOCC(=O)NC1(CC(=O)O)CCCC1
InChIInChI=1S/C12H21NO5/c1-17-6-7-18-9-10(14)13-12(8-11(15)16)4-2-3-5-12/h2-9H2,1H3,(H,13,14)(H,15,16)
InChIKeyFZCQILWNYWMBFQ-UHFFFAOYSA-N
XLogP0.55
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[1-(3-methoxypropanoylamino)cyclohexyl]acetic acid
CID 64672330
2-[1-[[2-(2-aminoethoxy)acetyl]amino]cyclobutyl]acetic acid
CID 79846049
2-[1-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentyl]acetic acid
CID 65241615
2-[1-[[2-(1-methoxycyclobutyl)acetyl]amino]cyclobutyl]acetic acid
CID 103555716
2-[1-[(2-phenoxyacetyl)amino]cyclopentyl]acetic acid
CID 64673162
2-[1-[[2-(methylamino)acetyl]amino]cyclohexyl]acetic acid
CID 64684909
2-ethoxy-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62519579
2-[1-[(2-methylsulfanylacetyl)amino]cyclohexyl]acetic acid
CID 64671362
1-[[[2-(2-methoxyethoxy)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 81361985
2-[1-[3-(propan-2-ylamino)propanoylamino]cyclopentyl]acetic acid
CID 64702277
2-[1-(3-methylsulfanylpropanoylamino)cyclohexyl]acetic acid
CID 64671361
2-[1-[4-(methylamino)butanoylamino]cyclopentyl]acetic acid
CID 64702109

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid (CID 64673171) is 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid is COCCOCC(=O)NC1(CC(=O)O)CCCC1.
What is the InChIKey of 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid?
The InChIKey is FZCQILWNYWMBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO5/c1-17-6-7-18-9-10(14)13-12(8-11(15)16)4-2-3-5-12/h2-9H2,1H3,(H,13,14)(H,15,16).
What are the key properties of 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid?
2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid has a molecular weight of 259.30 g/mol, XLogP of 0.55, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[2-(2-methoxyethoxy)acetyl]amino]cyclopentyl]acetic acid is sourced from PubChem (CID 64673171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).