propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate

C11H23NO3 — CID 63697938

IUPACpropan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate
SMILESCCOCCN(CC)CC(=O)OC(C)C
InChIInChI=1S/C11H23NO3/c1-5-12(7-8-14-6-2)9-11(13)15-10(3)4/h10H,5-9H2,1-4H3
InChIKeyVSZPJBHBRKPDNF-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.30
Rot. Bonds8

About propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate

propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate (PubChem CID 63697938) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate.

Molecular Properties

Compound Namepropan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate
PubChem CID63697938
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Namepropan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate
SMILESCCOCCN(CC)CC(=O)OC(C)C
InChIInChI=1S/C11H23NO3/c1-5-12(7-8-14-6-2)9-11(13)15-10(3)4/h10H,5-9H2,1-4H3
InChIKeyVSZPJBHBRKPDNF-UHFFFAOYSA-N
XLogP1.30
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

butyl 2-[bis(2-ethoxyethyl)amino]acetate
CID 82951802
ethane;ethyl 2-[ethyl(2-methoxyethyl)amino]acetate
CID 156838372
propan-2-yl 4-(2-ethoxyethoxy)butanoate
CID 121470224
N-(2-ethoxyethyl)-N-ethyl-2-methylidene-N'-propan-2-ylpropane-1,3-diamine
CID 103070650
2-[2-ethoxyethyl(ethyl)amino]ethyl 2-methylprop-2-enoate
CID 88906932
propan-2-yl 2-[2-cyanoethyl(2-methoxyethyl)amino]acetate
CID 63285599
propan-2-yl 2-[methyl(propanoyl)amino]acetate
CID 59695660
propan-2-yl 2-[ethyl(pyridin-4-ylmethyl)amino]acetate
CID 54940295
2-[2-ethoxyethyl(ethyl)amino]-1-(2,4,6-trimethylphenyl)ethanone
CID 63696690
2-ethoxy-4-[2-ethoxyethyl(ethyl)amino]butanoic acid
CID 63692704
ethyl 2-[bis[2-(2-ethoxy-2-oxoethoxy)ethyl]amino]acetate
CID 102349258
ethyl 3-[2-ethoxyethyl-(3-ethoxy-3-oxopropyl)amino]propanoate
CID 151749760

Frequently Asked Questions

What is the IUPAC name of propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate?
The IUPAC name of propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate (CID 63697938) is propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate.
What is the SMILES notation for propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate?
The canonical SMILES for propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate is CCOCCN(CC)CC(=O)OC(C)C.
What is the InChIKey of propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate?
The InChIKey is VSZPJBHBRKPDNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-5-12(7-8-14-6-2)9-11(13)15-10(3)4/h10H,5-9H2,1-4H3.
What are the key properties of propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate?
propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate has a molecular weight of 217.31 g/mol, XLogP of 1.30, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl 2-[2-ethoxyethyl(ethyl)amino]acetate is sourced from PubChem (CID 63697938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).