N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine

C11H26N2O2 — CID 103178048

IUPACN'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine
SMILESCCN(CCCN)CCOCCCOC
InChIInChI=1S/C11H26N2O2/c1-3-13(7-4-6-12)8-11-15-10-5-9-14-2/h3-12H2,1-2H3
InChIKeyXUOLNZCXQBIFNS-UHFFFAOYSA-N
MW218.34 g/mol
LogP0.71
Rot. Bonds11

About N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine

N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine (PubChem CID 103178048) has the molecular formula C11H26N2O2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine
PubChem CID103178048
Molecular FormulaC11H26N2O2
Molecular Weight218.34 g/mol
Exact Mass218.20
IUPAC NameN'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine
SMILESCCN(CCCN)CCOCCCOC
InChIInChI=1S/C11H26N2O2/c1-3-13(7-4-6-12)8-11-15-10-5-9-14-2/h3-12H2,1-2H3
InChIKeyXUOLNZCXQBIFNS-UHFFFAOYSA-N
XLogP0.71
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 50.71
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'-ethyl-N'-(2-methoxyethyl)propane-1,3-diamine
CID 43137192
3-bromo-N-ethyl-N-[2-(3-methoxypropoxy)ethyl]propan-1-amine
CID 103184049
N'-ethyl-N'-(2-propoxyethyl)propane-1,3-diamine
CID 106450802
N'-ethyl-N'-(2-methoxyethyl)hexane-1,6-diamine
CID 61447800
4-[2-(diethylamino)ethoxy]butan-1-amine
CID 62459330
N'-(2-ethoxyethyl)-N'-(2-methoxyethyl)propane-1,3-diamine
CID 55220253
N'-ethyl-N'-[2-(2,2,2-trifluoroethoxy)ethyl]propane-1,3-diamine
CID 61492236
N-ethyl-3-methoxy-N-(2-methoxyethyl)propan-1-amine
CID 143003406
N'-(2-butoxyethyl)-N'-ethylethane-1,2-diamine
CID 61483279
N-ethyl-N-(2-hexoxyethyl)-2-methoxyethanamine
CID 145404707
1-[ethyl-[2-(3-methoxypropoxy)ethyl]amino]-2-methylpropan-2-ol
CID 103182794
N,N-diethyl-3-methoxypropan-1-amine;ethane
CID 142226095

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine?
The IUPAC name of N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine (CID 103178048) is N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine.
What is the SMILES notation for N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine?
The canonical SMILES for N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine is CCN(CCCN)CCOCCCOC.
What is the InChIKey of N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine?
The InChIKey is XUOLNZCXQBIFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O2/c1-3-13(7-4-6-12)8-11-15-10-5-9-14-2/h3-12H2,1-2H3.
What are the key properties of N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine?
N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine has a molecular weight of 218.34 g/mol, XLogP of 0.71, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-[2-(3-methoxypropoxy)ethyl]propane-1,3-diamine is sourced from PubChem (CID 103178048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).