2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol

C16H26N2O2 — CID 64826781

IUPAC2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol
SMILESCCC1COC(C)CN1CC(N)(CO)c1ccccc1
InChIInChI=1S/C16H26N2O2/c1-3-15-10-20-13(2)9-18(15)11-16(17,12-19)14-7-5-4-6-8-14/h4-8,13,15,19H,3,9-12,17H2,1-2H3
InChIKeyXCGOSFJAGJXHKM-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.33
Rot. Bonds5

About 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol

2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol (PubChem CID 64826781) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol.

Molecular Properties

Compound Name2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol
PubChem CID64826781
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol
SMILESCCC1COC(C)CN1CC(N)(CO)c1ccccc1
InChIInChI=1S/C16H26N2O2/c1-3-15-10-20-13(2)9-18(15)11-16(17,12-19)14-7-5-4-6-8-14/h4-8,13,15,19H,3,9-12,17H2,1-2H3
InChIKeyXCGOSFJAGJXHKM-UHFFFAOYSA-N
XLogP1.33
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol?
The IUPAC name of 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol (CID 64826781) is 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol.
What is the SMILES notation for 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol?
The canonical SMILES for 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol is CCC1COC(C)CN1CC(N)(CO)c1ccccc1.
What is the InChIKey of 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol?
The InChIKey is XCGOSFJAGJXHKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-3-15-10-20-13(2)9-18(15)11-16(17,12-19)14-7-5-4-6-8-14/h4-8,13,15,19H,3,9-12,17H2,1-2H3.
What are the key properties of 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol?
2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol has a molecular weight of 278.40 g/mol, XLogP of 1.33, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(5-ethyl-2-methylmorpholin-4-yl)-2-phenylpropan-1-ol is sourced from PubChem (CID 64826781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).