2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine

C14H28N2O — CID 79657333

IUPAC2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine
SMILESC=C(C)C(NCCC)C1CN(CCC)CCO1
InChIInChI=1S/C14H28N2O/c1-5-7-15-14(12(3)4)13-11-16(8-6-2)9-10-17-13/h13-15H,3,5-11H2,1-2,4H3
InChIKeyIAQPDUZWOOSPJW-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.04
Rot. Bonds7

About 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine

2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine (PubChem CID 79657333) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine.

Molecular Properties

Compound Name2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine
PubChem CID79657333
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine
SMILESC=C(C)C(NCCC)C1CN(CCC)CCO1
InChIInChI=1S/C14H28N2O/c1-5-7-15-14(12(3)4)13-11-16(8-6-2)9-10-17-13/h13-15H,3,5-11H2,1-2,4H3
InChIKeyIAQPDUZWOOSPJW-UHFFFAOYSA-N
XLogP2.04
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine?
The IUPAC name of 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine (CID 79657333) is 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine.
What is the SMILES notation for 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine?
The canonical SMILES for 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine is C=C(C)C(NCCC)C1CN(CCC)CCO1.
What is the InChIKey of 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine?
The InChIKey is IAQPDUZWOOSPJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-7-15-14(12(3)4)13-11-16(8-6-2)9-10-17-13/h13-15H,3,5-11H2,1-2,4H3.
What are the key properties of 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine?
2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine has a molecular weight of 240.39 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propyl-1-(4-propylmorpholin-2-yl)prop-2-en-1-amine is sourced from PubChem (CID 79657333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).