N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine

C10H24N2O — CID 81055341

IUPACN-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine
SMILESCCOCCN(C)CC(C)CCN
InChIInChI=1S/C10H24N2O/c1-4-13-8-7-12(3)9-10(2)5-6-11/h10H,4-9,11H2,1-3H3
InChIKeyJBNSOUSHLJRVCF-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.94
Rot. Bonds8

About N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine

N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine (PubChem CID 81055341) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine
PubChem CID81055341
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC NameN-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine
SMILESCCOCCN(C)CC(C)CCN
InChIInChI=1S/C10H24N2O/c1-4-13-8-7-12(3)9-10(2)5-6-11/h10H,4-9,11H2,1-3H3
InChIKeyJBNSOUSHLJRVCF-UHFFFAOYSA-N
XLogP0.94
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.94
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-dimethylpentane-1,5-diamine
CID 104682346
5-ethoxy-3-methylpentan-1-amine
CID 87063287
3-N-(2-ethoxyethyl)-3-N-ethylbutane-1,3-diamine
CID 63698411
1-N-(2-ethoxyethyl)-4-methoxy-1-N-methylbutane-1,2-diamine
CID 81056203
6-amino-N,N-bis(2-ethoxyethyl)-4-methylhexanamide
CID 82966076
1-[2-ethoxyethyl(methyl)amino]pentan-2-ol
CID 81061715
N'-(2-ethoxyethyl)-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine
CID 103366414
3-[2-ethoxyethyl(methyl)amino]-N'-hydroxy-2-methylpropanimidamide
CID 76910844
1-N-(2-ethoxyethyl)-1-N,3-dimethyl-2-N-propylbutane-1,2-diamine
CID 81058530
5-[2-ethoxyethyl(methyl)amino]-3-methylpentane-1-thiol
CID 81063902
N,2-dimethyl-N-[2-[2-(4-methylhexoxy)ethoxy]ethyl]pentan-1-amine
CID 170062056
N-(3-ethoxypropyl)-N,N',2-trimethylpropane-1,3-diamine
CID 106915894

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine?
The IUPAC name of N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine (CID 81055341) is N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine.
What is the SMILES notation for N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine?
The canonical SMILES for N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine is CCOCCN(C)CC(C)CCN.
What is the InChIKey of N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine?
The InChIKey is JBNSOUSHLJRVCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-4-13-8-7-12(3)9-10(2)5-6-11/h10H,4-9,11H2,1-3H3.
What are the key properties of N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine?
N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine has a molecular weight of 188.31 g/mol, XLogP of 0.94, 8 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-dimethylbutane-1,4-diamine is sourced from PubChem (CID 81055341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).