2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine

C9H18N2O — CID 89074126

IUPAC2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine
SMILESC=C(CN)N1CC(C)OC(C)C1
InChIInChI=1S/C9H18N2O/c1-7(4-10)11-5-8(2)12-9(3)6-11/h8-9H,1,4-6,10H2,2-3H3
InChIKeyJUXDRIFCTSJIRM-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.57
Rot. Bonds2

About 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine

2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine (PubChem CID 89074126) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine
PubChem CID89074126
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine
SMILESC=C(CN)N1CC(C)OC(C)C1
InChIInChI=1S/C9H18N2O/c1-7(4-10)11-5-8(2)12-9(3)6-11/h8-9H,1,4-6,10H2,2-3H3
InChIKeyJUXDRIFCTSJIRM-UHFFFAOYSA-N
XLogP0.57
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine (CID 89074126) is 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine is C=C(CN)N1CC(C)OC(C)C1.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine?
The InChIKey is JUXDRIFCTSJIRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(4-10)11-5-8(2)12-9(3)6-11/h8-9H,1,4-6,10H2,2-3H3.
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine?
2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine has a molecular weight of 170.26 g/mol, XLogP of 0.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-amine is sourced from PubChem (CID 89074126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).