methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate

C15H31NO5 — CID 103179847

IUPACmethyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate
SMILESCCNC(C)(CCCOCCOCCCOC)C(=O)OC
InChIInChI=1S/C15H31NO5/c1-5-16-15(2,14(17)19-4)8-6-10-20-12-13-21-11-7-9-18-3/h16H,5-13H2,1-4H3
InChIKeyRSBOOCIYJQUGBN-UHFFFAOYSA-N
MW305.42 g/mol
LogP1.38
Rot. Bonds14

About methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate

methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate (PubChem CID 103179847) has the molecular formula C15H31NO5 and a molecular weight of 305.42 g/mol. Its IUPAC name is methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate.

Molecular Properties

Compound Namemethyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate
PubChem CID103179847
Molecular FormulaC15H31NO5
Molecular Weight305.42 g/mol
Exact Mass305.22
IUPAC Namemethyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate
SMILESCCNC(C)(CCCOCCOCCCOC)C(=O)OC
InChIInChI=1S/C15H31NO5/c1-5-16-15(2,14(17)19-4)8-6-10-20-12-13-21-11-7-9-18-3/h16H,5-13H2,1-4H3
InChIKeyRSBOOCIYJQUGBN-UHFFFAOYSA-N
XLogP1.38
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoic acid
CID 103179851
methyl 2-(ethylamino)-2-methyl-6-(4,4,4-trifluorobutoxy)hexanoate
CID 82783283
2-(ethylamino)-6-[2-(2-methoxyethoxy)ethoxy]-2-methylhexanamide
CID 104565452
methyl 2-(ethylamino)-4-(3-methoxy-3-methylbutoxy)-2-methylbutanoate
CID 106666755
methyl 2-(ethylamino)-2-methylpentanoate
CID 60788198
methyl 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropanoate
CID 103400749
2-[2-(3-methoxypropoxy)ethylamino]-2-methylpentanoic acid
CID 103181243
methyl 2-methyl-2-(propylamino)-5-(3,3,3-trifluoropropoxy)pentanoate
CID 82957801
methyl 2-(ethylamino)-2-methyl-5-(1,1,1-trifluoropropan-2-yloxy)pentanoate
CID 66275923
2-(ethylamino)-5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpentanenitrile
CID 104564868
methyl 2-(cyclopropylamino)-4-[3-(2-methoxyethoxy)propoxy]-2-methylbutanoate
CID 103404585
ethyl 4-[2-(3-methoxypropoxy)ethoxy]-2-methyl-2-(methylamino)butanoate
CID 103180000

Frequently Asked Questions

What is the IUPAC name of methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate?
The IUPAC name of methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate (CID 103179847) is methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate.
What is the SMILES notation for methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate?
The canonical SMILES for methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate is CCNC(C)(CCCOCCOCCCOC)C(=O)OC.
What is the InChIKey of methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate?
The InChIKey is RSBOOCIYJQUGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO5/c1-5-16-15(2,14(17)19-4)8-6-10-20-12-13-21-11-7-9-18-3/h16H,5-13H2,1-4H3.
What are the key properties of methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate?
methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate has a molecular weight of 305.42 g/mol, XLogP of 1.38, 14 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(ethylamino)-5-[2-(3-methoxypropoxy)ethoxy]-2-methylpentanoate is sourced from PubChem (CID 103179847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).