N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine

C8H17NO — CID 23217879

IUPACN,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine
SMILESC=C(C)COC(C)N(C)C
InChIInChI=1S/C8H17NO/c1-7(2)6-10-8(3)9(4)5/h8H,1,6H2,2-5H3
InChIKeyKXQLEZJQDFGDEU-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.49
Rot. Bonds4

About N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine

N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine (PubChem CID 23217879) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine
PubChem CID23217879
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine
SMILESC=C(C)COC(C)N(C)C
InChIInChI=1S/C8H17NO/c1-7(2)6-10-8(3)9(4)5/h8H,1,6H2,2-5H3
InChIKeyKXQLEZJQDFGDEU-UHFFFAOYSA-N
XLogP1.49
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine?
The IUPAC name of N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine (CID 23217879) is N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine.
What is the SMILES notation for N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine?
The canonical SMILES for N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine is C=C(C)COC(C)N(C)C.
What is the InChIKey of N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine?
The InChIKey is KXQLEZJQDFGDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)6-10-8(3)9(4)5/h8H,1,6H2,2-5H3.
What are the key properties of N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine?
N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine has a molecular weight of 143.23 g/mol, XLogP of 1.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(2-methylprop-2-enoxy)ethanamine is sourced from PubChem (CID 23217879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).