1-methoxyprop-1-ene;N-methylprop-1-en-1-amine

C8H17NO — CID 91202906

IUPAC1-methoxyprop-1-ene;N-methylprop-1-en-1-amine
SMILESCC=CNC.CC=COC
InChIInChI=1S/C4H9N.C4H8O/c2*1-3-4-5-2/h3-5H,1-2H3;3-4H,1-2H3
InChIKeyQFAFUPSIQJUKSL-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.91
Rot. Bonds2

About 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine

1-methoxyprop-1-ene;N-methylprop-1-en-1-amine (PubChem CID 91202906) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine.

Molecular Properties

Compound Name1-methoxyprop-1-ene;N-methylprop-1-en-1-amine
PubChem CID91202906
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name1-methoxyprop-1-ene;N-methylprop-1-en-1-amine
SMILESCC=CNC.CC=COC
InChIInChI=1S/C4H9N.C4H8O/c2*1-3-4-5-2/h3-5H,1-2H3;3-4H,1-2H3
InChIKeyQFAFUPSIQJUKSL-UHFFFAOYSA-N
XLogP1.91
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.91
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 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine?
The IUPAC name of 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine (CID 91202906) is 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine.
What is the SMILES notation for 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine?
The canonical SMILES for 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine is CC=CNC.CC=COC.
What is the InChIKey of 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine?
The InChIKey is QFAFUPSIQJUKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N.C4H8O/c2*1-3-4-5-2/h3-5H,1-2H3;3-4H,1-2H3.
What are the key properties of 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine?
1-methoxyprop-1-ene;N-methylprop-1-en-1-amine has a molecular weight of 143.23 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxyprop-1-ene;N-methylprop-1-en-1-amine is sourced from PubChem (CID 91202906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).