butyl 2-[2-methoxyethyl(methyl)amino]acetate

C10H21NO3 — CID 61067992

IUPACbutyl 2-[2-methoxyethyl(methyl)amino]acetate
SMILESCCCCOC(=O)CN(C)CCOC
InChIInChI=1S/C10H21NO3/c1-4-5-7-14-10(12)9-11(2)6-8-13-3/h4-9H2,1-3H3
InChIKeyZLUFCCZVHISGOH-UHFFFAOYSA-N
MW203.28 g/mol
LogP0.91
Rot. Bonds8

About butyl 2-[2-methoxyethyl(methyl)amino]acetate

butyl 2-[2-methoxyethyl(methyl)amino]acetate (PubChem CID 61067992) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is butyl 2-[2-methoxyethyl(methyl)amino]acetate.

Molecular Properties

Compound Namebutyl 2-[2-methoxyethyl(methyl)amino]acetate
PubChem CID61067992
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Namebutyl 2-[2-methoxyethyl(methyl)amino]acetate
SMILESCCCCOC(=O)CN(C)CCOC
InChIInChI=1S/C10H21NO3/c1-4-5-7-14-10(12)9-11(2)6-8-13-3/h4-9H2,1-3H3
InChIKeyZLUFCCZVHISGOH-UHFFFAOYSA-N
XLogP0.91
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 50.91
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

methyl 2-[(2-butoxy-2-oxoethyl)-methylamino]acetate
CID 60697821
butyl 2-(dimethylamino)acetate;methane
CID 157088664
butyl 3-[ethyl(methyl)amino]propanoate
CID 20769162
2-methoxyethyl 2-[hexyl-[2-(2-methoxyethoxy)-2-oxoethyl]amino]acetate
CID 101491584
methyl 2-[(2-butoxy-2-oxoethyl)-propylamino]acetate
CID 62012348
butyl 2-[bis(2-ethoxyethyl)amino]acetate
CID 82951802
propyl 3-[(2-methoxy-2-oxoethyl)-methylamino]propanoate
CID 118199886
methyl 2-[methyl(octyl)amino]acetate
CID 62028594
methyl 2-[methyl(nonyl)amino]acetate
CID 61238688
butyl 8-methoxyoctanoate
CID 155647547
butyl 2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 91703100
butyl 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 91703098

Frequently Asked Questions

What is the IUPAC name of butyl 2-[2-methoxyethyl(methyl)amino]acetate?
The IUPAC name of butyl 2-[2-methoxyethyl(methyl)amino]acetate (CID 61067992) is butyl 2-[2-methoxyethyl(methyl)amino]acetate.
What is the SMILES notation for butyl 2-[2-methoxyethyl(methyl)amino]acetate?
The canonical SMILES for butyl 2-[2-methoxyethyl(methyl)amino]acetate is CCCCOC(=O)CN(C)CCOC.
What is the InChIKey of butyl 2-[2-methoxyethyl(methyl)amino]acetate?
The InChIKey is ZLUFCCZVHISGOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-4-5-7-14-10(12)9-11(2)6-8-13-3/h4-9H2,1-3H3.
What are the key properties of butyl 2-[2-methoxyethyl(methyl)amino]acetate?
butyl 2-[2-methoxyethyl(methyl)amino]acetate has a molecular weight of 203.28 g/mol, XLogP of 0.91, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for butyl 2-[2-methoxyethyl(methyl)amino]acetate is sourced from PubChem (CID 61067992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).