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

C11H25NO3 — CID 103409669

IUPAC2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine
SMILESCCOC(C)CNCCCOCCOC
InChIInChI=1S/C11H25NO3/c1-4-15-11(2)10-12-6-5-7-14-9-8-13-3/h11-12H,4-10H2,1-3H3
InChIKeyBSWZXUAJPGZFRB-UHFFFAOYSA-N
MW219.32 g/mol
LogP1.05
Rot. Bonds11

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

2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine (PubChem CID 103409669) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine.

Molecular Properties

Compound Name2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine
PubChem CID103409669
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC Name2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine
SMILESCCOC(C)CNCCCOCCOC
InChIInChI=1S/C11H25NO3/c1-4-15-11(2)10-12-6-5-7-14-9-8-13-3/h11-12H,4-10H2,1-3H3
InChIKeyBSWZXUAJPGZFRB-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

2-[2-(2-methoxyethoxy)ethoxy]-N-(3-methoxypropyl)propan-1-amine
CID 104567209
N-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-2-methylpropan-1-amine
CID 104560835
2-ethyl-N-[3-(2-methoxyethoxy)propyl]butan-1-amine
CID 28720680
N-(3-ethoxypropyl)-2-methoxypropan-1-amine
CID 62565576
4-(2-methoxyethoxy)-N-(2-methylpropyl)butan-1-amine
CID 62456720
3-chloro-N-[3-(2-methoxyethoxy)propyl]-2-methylpropan-1-amine
CID 103413068
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]propyl]-3-methylbutan-1-amine
CID 104567163
N,N'-bis[2-(2-methoxyethoxy)propyl]ethane-1,2-diamine
CID 58589932
2-heptoxy-N-(3-methoxypropyl)propan-1-amine
CID 62597976
3-ethyl-1-[3-(2-methoxyethoxy)propylamino]pentan-2-ol
CID 106286221
(2S)-2-ethoxy-N-propylpropan-1-amine
CID 176570323
N-[2-(2-ethoxyethoxy)propyl]pentan-1-amine
CID 62565008

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine?
The IUPAC name of 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine (CID 103409669) is 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine.
What is the SMILES notation for 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine?
The canonical SMILES for 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine is CCOC(C)CNCCCOCCOC.
What is the InChIKey of 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine?
The InChIKey is BSWZXUAJPGZFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-4-15-11(2)10-12-6-5-7-14-9-8-13-3/h11-12H,4-10H2,1-3H3.
What are the key properties of 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine?
2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-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 2-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-1-amine is sourced from PubChem (CID 103409669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).