3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine

C15H24N2O — CID 43562330

IUPAC3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine
SMILESCCC1CN(CC(CN)c2ccccc2)CCO1
InChIInChI=1S/C15H24N2O/c1-2-15-12-17(8-9-18-15)11-14(10-16)13-6-4-3-5-7-13/h3-7,14-15H,2,8-12,16H2,1H3
InChIKeyQZCQUYCCFJJMHJ-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.84
Rot. Bonds5

About 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine

3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine (PubChem CID 43562330) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine.

Molecular Properties

Compound Name3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine
PubChem CID43562330
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine
SMILESCCC1CN(CC(CN)c2ccccc2)CCO1
InChIInChI=1S/C15H24N2O/c1-2-15-12-17(8-9-18-15)11-14(10-16)13-6-4-3-5-7-13/h3-7,14-15H,2,8-12,16H2,1H3
InChIKeyQZCQUYCCFJJMHJ-UHFFFAOYSA-N
XLogP1.84
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine?
The IUPAC name of 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine (CID 43562330) is 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine.
What is the SMILES notation for 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine?
The canonical SMILES for 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine is CCC1CN(CC(CN)c2ccccc2)CCO1.
What is the InChIKey of 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine?
The InChIKey is QZCQUYCCFJJMHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-15-12-17(8-9-18-15)11-14(10-16)13-6-4-3-5-7-13/h3-7,14-15H,2,8-12,16H2,1H3.
What are the key properties of 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine?
3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 1.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine is sourced from PubChem (CID 43562330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).