2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride

C16H25ClN2O2 — CID 120590349

IUPAC2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride
SMILESCCC1CN(C(=O)C(C)(N)c2ccccc2)CC(C)O1.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-4-14-11-18(10-12(2)20-14)15(19)16(3,17)13-8-6-5-7-9-13;/h5-9,12,14H,4,10-11,17H2,1-3H3;1H
InChIKeyQOVFYCDYYIHDFX-UHFFFAOYSA-N
MW312.84 g/mol
LogP2.31
Rot. Bonds3

About 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride

2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride (PubChem CID 120590349) has the molecular formula C16H25ClN2O2 and a molecular weight of 312.84 g/mol. Its IUPAC name is 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride.

Molecular Properties

Compound Name2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride
PubChem CID120590349
Molecular FormulaC16H25ClN2O2
Molecular Weight312.84 g/mol
Exact Mass312.16
IUPAC Name2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride
SMILESCCC1CN(C(=O)C(C)(N)c2ccccc2)CC(C)O1.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-4-14-11-18(10-12(2)20-14)15(19)16(3,17)13-8-6-5-7-9-13;/h5-9,12,14H,4,10-11,17H2,1-3H3;1H
InChIKeyQOVFYCDYYIHDFX-UHFFFAOYSA-N
XLogP2.31
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.84
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-methylpentan-1-one;hydrochloride
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2-amino-2-phenyl-1-(2,2,6-trimethylmorpholin-4-yl)propan-1-one;hydrochloride
CID 120590196
[4-(aminomethyl)phenyl]-(2-ethyl-6-methylmorpholin-4-yl)methanone;hydrochloride
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(2R)-2-amino-1-[(2R,6S)-2-ethyl-6-methylmorpholin-4-yl]-3-phenylpropan-1-one
CID 125133936
(1-aminocyclopropyl)-(2-ethyl-6-methylmorpholin-4-yl)methanone;hydrochloride
CID 119751390
2-amino-2-phenyl-1-(3-propylpiperidin-1-yl)propan-1-one;hydrochloride
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3-amino-1-(2-ethyl-6-methylmorpholin-4-yl)propan-1-one
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(4-tert-butylphenyl)-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methanone
CID 102934330
2-benzyl-N-tert-butyl-6-methylmorpholine-4-carboxamide
CID 110746739
2-amino-N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-phenylpropanamide
CID 120595010
2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)propan-1-one;hydrochloride
CID 119304817

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride?
The IUPAC name of 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride (CID 120590349) is 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride.
What is the SMILES notation for 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride?
The canonical SMILES for 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride is CCC1CN(C(=O)C(C)(N)c2ccccc2)CC(C)O1.Cl.
What is the InChIKey of 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride?
The InChIKey is QOVFYCDYYIHDFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2.ClH/c1-4-14-11-18(10-12(2)20-14)15(19)16(3,17)13-8-6-5-7-9-13;/h5-9,12,14H,4,10-11,17H2,1-3H3;1H.
What are the key properties of 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride?
2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride has a molecular weight of 312.84 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-phenylpropan-1-one;hydrochloride is sourced from PubChem (CID 120590349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).