2-methoxy-N-methylprop-2-en-1-amine

C5H11NO — CID 20826383

IUPAC2-methoxy-N-methylprop-2-en-1-amine
SMILESC=C(CNC)OC
InChIInChI=1S/C5H11NO/c1-5(7-3)4-6-2/h6H,1,4H2,2-3H3
InChIKeyBCCYDHGURXFNED-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.37
Rot. Bonds3

About 2-methoxy-N-methylprop-2-en-1-amine

2-methoxy-N-methylprop-2-en-1-amine (PubChem CID 20826383) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is 2-methoxy-N-methylprop-2-en-1-amine.

Molecular Properties

Compound Name2-methoxy-N-methylprop-2-en-1-amine
PubChem CID20826383
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name2-methoxy-N-methylprop-2-en-1-amine
SMILESC=C(CNC)OC
InChIInChI=1S/C5H11NO/c1-5(7-3)4-6-2/h6H,1,4H2,2-3H3
InChIKeyBCCYDHGURXFNED-UHFFFAOYSA-N
XLogP0.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.37
H-Bond Donors ≤ 51
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 2-methoxy-N-methylprop-2-en-1-amine?
The IUPAC name of 2-methoxy-N-methylprop-2-en-1-amine (CID 20826383) is 2-methoxy-N-methylprop-2-en-1-amine.
What is the SMILES notation for 2-methoxy-N-methylprop-2-en-1-amine?
The canonical SMILES for 2-methoxy-N-methylprop-2-en-1-amine is C=C(CNC)OC.
What is the InChIKey of 2-methoxy-N-methylprop-2-en-1-amine?
The InChIKey is BCCYDHGURXFNED-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-5(7-3)4-6-2/h6H,1,4H2,2-3H3.
What are the key properties of 2-methoxy-N-methylprop-2-en-1-amine?
2-methoxy-N-methylprop-2-en-1-amine has a molecular weight of 101.15 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methylprop-2-en-1-amine is sourced from PubChem (CID 20826383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).