1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine

C11H26N2O — CID 63697376

IUPAC1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine
SMILESCCNC(C)CN(CC)CCOCC
InChIInChI=1S/C11H26N2O/c1-5-12-11(4)10-13(6-2)8-9-14-7-3/h11-12H,5-10H2,1-4H3
InChIKeyYBQGIFDGGZICBY-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.34
Rot. Bonds9

About 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine

1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine (PubChem CID 63697376) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine
PubChem CID63697376
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine
SMILESCCNC(C)CN(CC)CCOCC
InChIInChI=1S/C11H26N2O/c1-5-12-11(4)10-13(6-2)8-9-14-7-3/h11-12H,5-10H2,1-4H3
InChIKeyYBQGIFDGGZICBY-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine 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-N-(3-ethoxypropyl)-1-N,1-N-diethylpropane-1,2-diamine
CID 65175830
1-N-(2-ethoxyethyl)-1-N,3-N-diethyl-2,2-dimethylbutane-1,3-diamine
CID 66453452
N-(2-ethoxyethyl)-N-ethyl-2-methyl-N'-propylpropane-1,3-diamine
CID 63691778
1-N-(2-ethoxyethyl)-1-N-ethyl-2-N-propylbutane-1,2-diamine
CID 63696660
N'-(2-ethoxyethyl)-N,N'-diethyl-1-(4-ethylphenyl)ethane-1,2-diamine
CID 63697022
N-(2-ethoxyethyl)-N-ethyl-2-methylidene-N'-propan-2-ylpropane-1,3-diamine
CID 103070650
3-[2-ethoxyethyl(ethyl)amino]-2-(methylamino)propanenitrile
CID 63690873
1-[2-ethoxyethyl(ethyl)amino]-3,3-dimethylbutan-2-ol
CID 63691569
3-[2-ethoxyethyl(ethyl)amino]-2-(propylamino)propanoic acid
CID 55228271
N-(2-ethoxyethyl)-N'-ethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62575445
1-N,1-N-bis(2-ethoxyethyl)-3-N-ethyl-2,2-dimethylbutane-1,3-diamine
CID 82952294
3-[2-ethoxyethyl(ethyl)amino]-2-(propylamino)propanamide
CID 63690176

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine?
The IUPAC name of 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine (CID 63697376) is 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine.
What is the SMILES notation for 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine?
The canonical SMILES for 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine is CCNC(C)CN(CC)CCOCC.
What is the InChIKey of 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine?
The InChIKey is YBQGIFDGGZICBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-5-12-11(4)10-13(6-2)8-9-14-7-3/h11-12H,5-10H2,1-4H3.
What are the key properties of 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine?
1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine has a molecular weight of 202.34 g/mol, XLogP of 1.34, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine is sourced from PubChem (CID 63697376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).