1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine

C11H25NO3 — CID 115707889

IUPAC1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine
SMILESCCOCC(C)NCCCOCCOC
InChIInChI=1S/C11H25NO3/c1-4-14-10-11(2)12-6-5-7-15-9-8-13-3/h11-12H,4-10H2,1-3H3
InChIKeyRMIXHOXGQAMLIP-UHFFFAOYSA-N
MW219.32 g/mol
LogP1.05
Rot. Bonds11

About 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine

1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine (PubChem CID 115707889) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine.

Molecular Properties

Compound Name1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine
PubChem CID115707889
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC Name1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine
SMILESCCOCC(C)NCCCOCCOC
InChIInChI=1S/C11H25NO3/c1-4-14-10-11(2)12-6-5-7-15-9-8-13-3/h11-12H,4-10H2,1-3H3
InChIKeyRMIXHOXGQAMLIP-UHFFFAOYSA-N
XLogP1.05
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.32
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-1-ethoxypropan-2-amine
CID 104562069
N'-(1-ethoxypropan-2-yl)-N-(3-methoxypropyl)methanediamine
CID 57301622
N-[3-(2-methoxyethoxy)propyl]-5-methylhexan-2-amine
CID 43206916
N-[3-(cyclopropylmethoxy)propyl]-1-ethoxypropan-2-amine
CID 115707824
4-bromo-N-[3-(2-methoxyethoxy)propyl]butan-2-amine
CID 103413141
4-methoxy-N-[3-(2-methoxyethoxy)propyl]-4-methylpentan-2-amine
CID 43147222
4-bromo-N-[3-(2-methoxyethoxy)propyl]pentan-2-amine
CID 103413145
N-[3-(2-methoxyethoxy)propyl]pentan-3-amine
CID 28720947
N-(3-ethoxypropyl)butan-2-amine
CID 43196213
1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine
CID 115713728
5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-N-propan-2-ylpentan-1-amine
CID 104566618
methyl 2-[3-(2-methoxyethoxy)propylamino]propanoate
CID 66173501

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine?
The IUPAC name of 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine (CID 115707889) is 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine.
What is the SMILES notation for 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine?
The canonical SMILES for 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine is CCOCC(C)NCCCOCCOC.
What is the InChIKey of 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine?
The InChIKey is RMIXHOXGQAMLIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-4-14-10-11(2)12-6-5-7-15-9-8-13-3/h11-12H,4-10H2,1-3H3.
What are the key properties of 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine?
1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine has a molecular weight of 219.32 g/mol, XLogP of 1.05, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine is sourced from PubChem (CID 115707889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).