N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine

C10H24N2O — CID 170129105

IUPACN-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine
SMILESCC(C)N(C)CCOCCN(C)C
InChIInChI=1S/C10H24N2O/c1-10(2)12(5)7-9-13-8-6-11(3)4/h10H,6-9H2,1-5H3
InChIKeyWZNGEPUJLNZNKZ-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.90
Rot. Bonds7

About N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine

N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine (PubChem CID 170129105) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine
PubChem CID170129105
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC NameN-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine
SMILESCC(C)N(C)CCOCCN(C)C
InChIInChI=1S/C10H24N2O/c1-10(2)12(5)7-9-13-8-6-11(3)4/h10H,6-9H2,1-5H3
InChIKeyWZNGEPUJLNZNKZ-UHFFFAOYSA-N
XLogP0.90
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine?
The IUPAC name of N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine (CID 170129105) is N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine.
What is the SMILES notation for N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine?
The canonical SMILES for N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine is CC(C)N(C)CCOCCN(C)C.
What is the InChIKey of N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine?
The InChIKey is WZNGEPUJLNZNKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-10(2)12(5)7-9-13-8-6-11(3)4/h10H,6-9H2,1-5H3.
What are the key properties of N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine?
N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine has a molecular weight of 188.31 g/mol, XLogP of 0.90, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine is sourced from PubChem (CID 170129105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).