2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine

C12H26N2O — CID 82744251

IUPAC2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine
SMILESCCC(C)(CNC)CN(C)C1CCOC1
InChIInChI=1S/C12H26N2O/c1-5-12(2,9-13-3)10-14(4)11-6-7-15-8-11/h11,13H,5-10H2,1-4H3
InChIKeyZZKDOKJCAWUQRF-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds6

About 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine

2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine (PubChem CID 82744251) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine.

Molecular Properties

Compound Name2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine
PubChem CID82744251
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine
SMILESCCC(C)(CNC)CN(C)C1CCOC1
InChIInChI=1S/C12H26N2O/c1-5-12(2,9-13-3)10-14(4)11-6-7-15-8-11/h11,13H,5-10H2,1-4H3
InChIKeyZZKDOKJCAWUQRF-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-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

N,2-diethyl-N',2-dimethyl-N'-(oxolan-3-yl)propane-1,3-diamine
CID 82744178
2,2-diethyl-N,N'-dimethyl-N'-(oxolan-3-yl)propane-1,3-diamine
CID 82743370
N,2-diethyl-N',2-dimethyl-N'-(oxan-4-yl)propane-1,3-diamine
CID 55051396
2-ethyl-N,2-dimethyl-N-(oxan-4-yl)-N'-propan-2-ylpropane-1,3-diamine
CID 62257896
N,2-dimethyl-N'-(2-methylpropyl)-N-(oxolan-3-yl)-2-propylpropane-1,3-diamine
CID 82743616
2-ethyl-2-[[methyl(oxolan-3-yl)amino]methyl]butane-1-thiol
CID 82744856
2-ethyl-2-[[methyl(oxolan-3-yl)amino]methyl]butanoic acid
CID 82743302
2-(cyclopropylamino)-2-methyl-3-[methyl(oxolan-3-yl)amino]propanenitrile
CID 82749204
N-ethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-amine
CID 82739733
N,N'-dimethyl-N,N'-bis[(3S)-oxolan-3-yl]but-2-yne-1,4-diamine
CID 124729941
ethyl 2-(cyclopropylamino)-2-methyl-3-[methyl(oxolan-3-yl)amino]propanoate
CID 82744284
N-butyl-N-methyloxolan-3-amine
CID 154189060

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine?
The IUPAC name of 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine (CID 82744251) is 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine.
What is the SMILES notation for 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine?
The canonical SMILES for 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine is CCC(C)(CNC)CN(C)C1CCOC1.
What is the InChIKey of 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine?
The InChIKey is ZZKDOKJCAWUQRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-12(2,9-13-3)10-14(4)11-6-7-15-8-11/h11,13H,5-10H2,1-4H3.
What are the key properties of 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine?
2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,N',2-trimethyl-N'-(oxolan-3-yl)propane-1,3-diamine is sourced from PubChem (CID 82744251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).