N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine

C13H30N2O — CID 63692665

IUPACN-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine
SMILESCCNCC(C)(C)CN(CC)CCOCC
InChIInChI=1S/C13H30N2O/c1-6-14-11-13(4,5)12-15(7-2)9-10-16-8-3/h14H,6-12H2,1-5H3
InChIKeyMLONIYCUZRFELV-UHFFFAOYSA-N
MW230.40 g/mol
LogP1.98
Rot. Bonds10

About N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine

N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine (PubChem CID 63692665) has the molecular formula C13H30N2O and a molecular weight of 230.40 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine
PubChem CID63692665
Molecular FormulaC13H30N2O
Molecular Weight230.40 g/mol
Exact Mass230.24
IUPAC NameN-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine
SMILESCCNCC(C)(C)CN(CC)CCOCC
InChIInChI=1S/C13H30N2O/c1-6-14-11-13(4,5)12-15(7-2)9-10-16-8-3/h14H,6-12H2,1-5H3
InChIKeyMLONIYCUZRFELV-UHFFFAOYSA-N
XLogP1.98
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.40
LogP ≤ 51.98
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-ethoxyethyl)-N-ethyl-2,2-dimethyl-N'-propylpropane-1,3-diamine
CID 55226146
4-ethoxy-N,N-diethyl-2,2-dimethylbutan-1-amine
CID 160537822
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'-propan-2-yl-2-propylpropane-1,3-diamine
CID 63690537
N'-(2-ethoxyethyl)-N'-ethyl-N-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 63692867
N-cyclopropyl-N'-(2-ethoxyethyl)-N',2,2-triethylpropane-1,3-diamine
CID 55225955
1-N,1-N-bis(2-ethoxyethyl)-3-N-ethyl-2,2-dimethylbutane-1,3-diamine
CID 82952294
N'-(3-ethoxypropyl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 65176530
N'-(2-ethoxyethyl)-N'-ethyl-N-methylethane-1,2-diamine
CID 58803335
N-[2-(dimethylamino)ethyl]-N'-ethyl-2,2-dimethyl-N-(2-methylpropyl)propane-1,3-diamine
CID 55056372
1-N-(2-ethoxyethyl)-1-N,2-N-diethylpropane-1,2-diamine
CID 63697376
N-(2-ethoxyethyl)-N-ethyl-2-methyl-2-piperazin-1-ylpropan-1-amine
CID 80550358

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine?
The IUPAC name of N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine (CID 63692665) is N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine.
What is the SMILES notation for N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine?
The canonical SMILES for N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine is CCNCC(C)(C)CN(CC)CCOCC.
What is the InChIKey of N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine?
The InChIKey is MLONIYCUZRFELV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O/c1-6-14-11-13(4,5)12-15(7-2)9-10-16-8-3/h14H,6-12H2,1-5H3.
What are the key properties of N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine?
N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine has a molecular weight of 230.40 g/mol, XLogP of 1.98, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N,N'-diethyl-2,2-dimethylpropane-1,3-diamine is sourced from PubChem (CID 63692665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).