2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate

C14H27NO5 — CID 104563132

IUPAC2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate
SMILESCOCCOCCOCCOC(=O)CNC1CCCC1
InChIInChI=1S/C14H27NO5/c1-17-6-7-18-8-9-19-10-11-20-14(16)12-15-13-4-2-3-5-13/h13,15H,2-12H2,1H3
InChIKeyLALAEWZLYDQREZ-UHFFFAOYSA-N
MW289.37 g/mol
LogP0.74
Rot. Bonds12

About 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate

2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate (PubChem CID 104563132) has the molecular formula C14H27NO5 and a molecular weight of 289.37 g/mol. Its IUPAC name is 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate.

Molecular Properties

Compound Name2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate
PubChem CID104563132
Molecular FormulaC14H27NO5
Molecular Weight289.37 g/mol
Exact Mass289.19
IUPAC Name2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate
SMILESCOCCOCCOCCOC(=O)CNC1CCCC1
InChIInChI=1S/C14H27NO5/c1-17-6-7-18-8-9-19-10-11-20-14(16)12-15-13-4-2-3-5-13/h13,15H,2-12H2,1H3
InChIKeyLALAEWZLYDQREZ-UHFFFAOYSA-N
XLogP0.74
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.37
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

butyl 2-(cyclooctylamino)acetate
CID 54917785
2-(2-methoxyethoxy)ethyl 2-(methylamino)acetate
CID 104563542
2-methoxyethyl 3-(cyclopropylamino)propanoate
CID 61301679
2-(2-methoxyethoxy)ethyl 2-(2-methoxyethylamino)acetate
CID 104563269
N-[2-(cycloheptylamino)ethyl]-2-(2-methoxyethoxy)acetamide;hydrochloride
CID 119620939
ethyl 2-[(4,4-dimethylcycloheptyl)amino]acetate
CID 65083489
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]cyclopropanamine
CID 104560665
2-[2-(2-methoxyethoxy)ethoxy]ethyl cyclobutanecarboxylate
CID 10192770
N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine
CID 103074416
2-(cyclohexylamino)-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 54816663
1-cyclopentyl-2-[2-(2-methoxyethoxy)ethyl]guanidine
CID 62367717
1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate
CID 103489239

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate?
The IUPAC name of 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate (CID 104563132) is 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate.
What is the SMILES notation for 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate?
The canonical SMILES for 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate is COCCOCCOCCOC(=O)CNC1CCCC1.
What is the InChIKey of 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate?
The InChIKey is LALAEWZLYDQREZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO5/c1-17-6-7-18-8-9-19-10-11-20-14(16)12-15-13-4-2-3-5-13/h13,15H,2-12H2,1H3.
What are the key properties of 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate?
2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate has a molecular weight of 289.37 g/mol, XLogP of 0.74, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate is sourced from PubChem (CID 104563132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).