N,N-diethyl-1-methoxyethenamine

C7H15NO — CID 14145668

IUPACN,N-diethyl-1-methoxyethenamine
SMILESC=C(OC)N(CC)CC
InChIInChI=1S/C7H15NO/c1-5-8(6-2)7(3)9-4/h3,5-6H2,1-2,4H3
InChIKeyRWNBOEAPISHTCQ-UHFFFAOYSA-N
MW129.20 g/mol
LogP1.45
Rot. Bonds4

About N,N-diethyl-1-methoxyethenamine

N,N-diethyl-1-methoxyethenamine (PubChem CID 14145668) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is N,N-diethyl-1-methoxyethenamine.

Molecular Properties

Compound NameN,N-diethyl-1-methoxyethenamine
PubChem CID14145668
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC NameN,N-diethyl-1-methoxyethenamine
SMILESC=C(OC)N(CC)CC
InChIInChI=1S/C7H15NO/c1-5-8(6-2)7(3)9-4/h3,5-6H2,1-2,4H3
InChIKeyRWNBOEAPISHTCQ-UHFFFAOYSA-N
XLogP1.45
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-methoxyethenamine?
The IUPAC name of N,N-diethyl-1-methoxyethenamine (CID 14145668) is N,N-diethyl-1-methoxyethenamine.
What is the SMILES notation for N,N-diethyl-1-methoxyethenamine?
The canonical SMILES for N,N-diethyl-1-methoxyethenamine is C=C(OC)N(CC)CC.
What is the InChIKey of N,N-diethyl-1-methoxyethenamine?
The InChIKey is RWNBOEAPISHTCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-5-8(6-2)7(3)9-4/h3,5-6H2,1-2,4H3.
What are the key properties of N,N-diethyl-1-methoxyethenamine?
N,N-diethyl-1-methoxyethenamine has a molecular weight of 129.20 g/mol, XLogP of 1.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-methoxyethenamine is sourced from PubChem (CID 14145668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).