2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine

C11H25NO2 — CID 106452518

IUPAC2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine
SMILESCCOC(C)CNCCOCC(C)C
InChIInChI=1S/C11H25NO2/c1-5-14-11(4)8-12-6-7-13-9-10(2)3/h10-12H,5-9H2,1-4H3
InChIKeyPHGCDUYJVIXYAV-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.67
Rot. Bonds9

About 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine

2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine (PubChem CID 106452518) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine.

Molecular Properties

Compound Name2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine
PubChem CID106452518
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine
SMILESCCOC(C)CNCCOCC(C)C
InChIInChI=1S/C11H25NO2/c1-5-14-11(4)8-12-6-7-13-9-10(2)3/h10-12H,5-9H2,1-4H3
InChIKeyPHGCDUYJVIXYAV-UHFFFAOYSA-N
XLogP1.67
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(2-methylpropoxy)ethoxy]propyl]butan-1-amine
CID 106450242
2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]propan-1-amine
CID 106449858
(2S)-2-ethoxy-N-propylpropan-1-amine
CID 176570323
2-chloro-N-[2-(2-methylpropoxy)ethyl]butan-1-amine
CID 106457838
N-(2-ethoxyethyl)-2-methylpropan-1-amine
CID 43387935
2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine
CID 103409669
1-[2-[2-[2-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]ethoxy]ethoxy]ethylamino]-3-propoxypropan-2-ol
CID 146475954
N',N'-diethyl-N-[2-(2-methylpropoxy)ethyl]ethane-1,2-diamine
CID 62565030
N-[2-(2-methylpropoxy)ethyl]-3-propoxypropan-1-amine
CID 106452398
1-(4-methylpentoxy)-3-[2-(2-methylpropoxy)ethylamino]propan-2-ol
CID 115585726
1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine
CID 115713728
N-[2-(2-ethoxyethoxy)propyl]pentan-1-amine
CID 62565008

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine?
The IUPAC name of 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine (CID 106452518) is 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine.
What is the SMILES notation for 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine?
The canonical SMILES for 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine is CCOC(C)CNCCOCC(C)C.
What is the InChIKey of 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine?
The InChIKey is PHGCDUYJVIXYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-5-14-11(4)8-12-6-7-13-9-10(2)3/h10-12H,5-9H2,1-4H3.
What are the key properties of 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine?
2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 1.67, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-1-amine is sourced from PubChem (CID 106452518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).