3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride

C13H19ClN2O2 — CID 119278810

IUPAC3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride
SMILESCl.NCCC(=O)N1CCOC(c2ccccc2)C1
InChIInChI=1S/C13H18N2O2.ClH/c14-7-6-13(16)15-8-9-17-12(10-15)11-4-2-1-3-5-11;/h1-5,12H,6-10,14H2;1H
InChIKeyNEBXYNUOVOFHRM-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.36
Rot. Bonds3

About 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride

3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride (PubChem CID 119278810) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride.

Molecular Properties

Compound Name3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride
PubChem CID119278810
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC Name3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride
SMILESCl.NCCC(=O)N1CCOC(c2ccccc2)C1
InChIInChI=1S/C13H18N2O2.ClH/c14-7-6-13(16)15-8-9-17-12(10-15)11-4-2-1-3-5-11;/h1-5,12H,6-10,14H2;1H
InChIKeyNEBXYNUOVOFHRM-UHFFFAOYSA-N
XLogP1.36
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-[2-(3-fluorophenyl)morpholin-4-yl]propan-1-one;hydrochloride
CID 119315907
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CID 154851772
2-amino-5-oxo-5-(2-phenylmorpholin-4-yl)pentanoic acid
CID 166748872
3-amino-1-[2-(3-chloro-4-fluorophenyl)morpholin-4-yl]propan-1-one;hydrochloride
CID 119315236
N-[3-oxo-3-[(2R)-2-phenylmorpholin-4-yl]propyl]benzamide
CID 31414440
4-amino-1-[2-(3-bromophenyl)morpholin-4-yl]butan-1-one;hydrochloride
CID 119308203
5-amino-1-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pentan-1-one
CID 95358094
3-(3,5-dimethylpyrazolidin-4-yl)-1-(2-phenylmorpholin-4-yl)propan-1-one
CID 134067569
3-amino-1-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]propan-1-one;hydrochloride
CID 154892310
7-amino-1-[2-(3-fluorophenyl)morpholin-4-yl]heptan-1-one;hydrochloride
CID 119770399
6-amino-1-[2-(4-fluorophenyl)morpholin-4-yl]hexan-1-one
CID 60963489
2-methyl-N-[4-oxo-4-(2-phenylmorpholin-4-yl)butyl]propanamide
CID 16894893

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride?
The IUPAC name of 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride (CID 119278810) is 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride.
What is the SMILES notation for 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride?
The canonical SMILES for 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride is Cl.NCCC(=O)N1CCOC(c2ccccc2)C1.
What is the InChIKey of 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride?
The InChIKey is NEBXYNUOVOFHRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2.ClH/c14-7-6-13(16)15-8-9-17-12(10-15)11-4-2-1-3-5-11;/h1-5,12H,6-10,14H2;1H.
What are the key properties of 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride?
3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride has a molecular weight of 270.76 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride is sourced from PubChem (CID 119278810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).