2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine

C6H14NOP — CID 143995884

IUPAC2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine
SMILESC=C(COC)CN(C)P
InChIInChI=1S/C6H14NOP/c1-6(5-8-3)4-7(2)9/h1,4-5,9H2,2-3H3
InChIKeyDSBMBIRGNPPUNP-UHFFFAOYSA-N
MW147.16 g/mol
LogP0.91
Rot. Bonds4

About 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine

2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine (PubChem CID 143995884) has the molecular formula C6H14NOP and a molecular weight of 147.16 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine
PubChem CID143995884
Molecular FormulaC6H14NOP
Molecular Weight147.16 g/mol
Exact Mass147.08
IUPAC Name2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine
SMILESC=C(COC)CN(C)P
InChIInChI=1S/C6H14NOP/c1-6(5-8-3)4-7(2)9/h1,4-5,9H2,2-3H3
InChIKeyDSBMBIRGNPPUNP-UHFFFAOYSA-N
XLogP0.91
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.16
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine?
The IUPAC name of 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine (CID 143995884) is 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine?
The canonical SMILES for 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine is C=C(COC)CN(C)P.
What is the InChIKey of 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine?
The InChIKey is DSBMBIRGNPPUNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14NOP/c1-6(5-8-3)4-7(2)9/h1,4-5,9H2,2-3H3.
What are the key properties of 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine?
2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine has a molecular weight of 147.16 g/mol, XLogP of 0.91, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-methyl-N-phosphanylprop-2-en-1-amine is sourced from PubChem (CID 143995884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).