N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine

C11H26N2O — CID 104682346

IUPACN-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine
SMILESCCOCCN(C)CC(C)CCCN
InChIInChI=1S/C11H26N2O/c1-4-14-9-8-13(3)10-11(2)6-5-7-12/h11H,4-10,12H2,1-3H3
InChIKeyONESGNNCEMYNHN-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.33
Rot. Bonds9

About N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine

N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine (PubChem CID 104682346) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine
PubChem CID104682346
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC NameN-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine
SMILESCCOCCN(C)CC(C)CCCN
InChIInChI=1S/C11H26N2O/c1-4-14-9-8-13(3)10-11(2)6-5-7-12/h11H,4-10,12H2,1-3H3
InChIKeyONESGNNCEMYNHN-UHFFFAOYSA-N
XLogP1.33
TPSA38.49 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 ≤ 51.33
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,2-dimethylbutane-1,4-diamine
CID 81055341
N,2-dimethyl-N-[2-[2-(4-methylhexoxy)ethoxy]ethyl]pentan-1-amine
CID 170062056
N'-(2-ethoxyethyl)-N'-propan-2-ylpropane-1,3-diamine
CID 43457099
1-N-(2-ethoxyethyl)-4-methoxy-1-N-methylbutane-1,2-diamine
CID 81056203
1-[2-ethoxyethyl(methyl)amino]-3-methoxypropan-2-ol
CID 62013826
1-[2-ethoxyethyl(methyl)amino]pentan-2-ol
CID 81061715
N'-(2-ethoxyethyl)-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine
CID 103366414
N-(3-ethoxypropyl)-N,N',2-trimethylpropane-1,3-diamine
CID 106915894
1-N-(2-ethoxyethyl)-1-N,3-dimethyl-2-N-propylbutane-1,2-diamine
CID 81058530
3-[2-ethoxyethyl(methyl)amino]-N'-hydroxy-2-methylpropanimidamide
CID 76910844
5-[2-ethoxyethyl(methyl)amino]-3-methylpentane-1-thiol
CID 81063902
3-N-(2-ethoxyethyl)-3-N-ethylbutane-1,3-diamine
CID 63698411

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine?
The IUPAC name of N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine (CID 104682346) is N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine.
What is the SMILES notation for N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine?
The canonical SMILES for N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine is CCOCCN(C)CC(C)CCCN.
What is the InChIKey of N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine?
The InChIKey is ONESGNNCEMYNHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-4-14-9-8-13(3)10-11(2)6-5-7-12/h11H,4-10,12H2,1-3H3.
What are the key properties of N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine?
N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine has a molecular weight of 202.34 g/mol, XLogP of 1.33, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine is sourced from PubChem (CID 104682346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).