2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride

C20H25ClN2O2 — CID 120667864

IUPAC2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride
SMILESCc1ccc(C(N)C(=O)N2CC(C)OC(c3ccccc3)C2)cc1.Cl
InChIInChI=1S/C20H24N2O2.ClH/c1-14-8-10-17(11-9-14)19(21)20(23)22-12-15(2)24-18(13-22)16-6-4-3-5-7-16;/h3-11,15,18-19H,12-13,21H2,1-2H3;1H
InChIKeyPZYLMOPYTHMCLU-UHFFFAOYSA-N
MW360.89 g/mol
LogP3.41
Rot. Bonds3

About 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride

2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride (PubChem CID 120667864) has the molecular formula C20H25ClN2O2 and a molecular weight of 360.89 g/mol. Its IUPAC name is 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride.

Molecular Properties

Compound Name2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride
PubChem CID120667864
Molecular FormulaC20H25ClN2O2
Molecular Weight360.89 g/mol
Exact Mass360.16
IUPAC Name2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride
SMILESCc1ccc(C(N)C(=O)N2CC(C)OC(c3ccccc3)C2)cc1.Cl
InChIInChI=1S/C20H24N2O2.ClH/c1-14-8-10-17(11-9-14)19(21)20(23)22-12-15(2)24-18(13-22)16-6-4-3-5-7-16;/h3-11,15,18-19H,12-13,21H2,1-2H3;1H
InChIKeyPZYLMOPYTHMCLU-UHFFFAOYSA-N
XLogP3.41
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.89
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-phenyl-1-(2-phenylmorpholin-4-yl)ethanone;hydrochloride
CID 119278824
(2-methyl-6-phenylmorpholin-4-yl)-phenylmethanone
CID 47914795
(2S)-2-amino-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-3-phenylpropan-1-one;hydrochloride
CID 84588635
(2R)-1-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]-2-pyrazol-1-ylpropan-1-one
CID 95583669
3-methyl-1-[2-methyl-6-(4-methylphenyl)morpholin-4-yl]butan-1-one
CID 110369052
(2S)-2-amino-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]propan-1-one
CID 119332587
2-amino-1-[2-(2-fluorophenyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone;hydrochloride
CID 120668203
2-amino-1-[2-(3-bromophenyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone
CID 120667995
2-amino-1-[2-(3-fluorophenyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone
CID 120668206
(3-bromo-2-hydroxy-5-methylphenyl)-[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]methanone
CID 95034994
cyclopentyl-[2-methyl-6-(4-methylphenyl)morpholin-4-yl]methanone
CID 110369056
2-amino-2-(4-methylphenyl)-1-(2-thiophen-2-ylmorpholin-4-yl)ethanone;hydrochloride
CID 120668000

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride?
The IUPAC name of 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride (CID 120667864) is 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride.
What is the SMILES notation for 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride?
The canonical SMILES for 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride is Cc1ccc(C(N)C(=O)N2CC(C)OC(c3ccccc3)C2)cc1.Cl.
What is the InChIKey of 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride?
The InChIKey is PZYLMOPYTHMCLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2.ClH/c1-14-8-10-17(11-9-14)19(21)20(23)22-12-15(2)24-18(13-22)16-6-4-3-5-7-16;/h3-11,15,18-19H,12-13,21H2,1-2H3;1H.
What are the key properties of 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride?
2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride has a molecular weight of 360.89 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(4-methylphenyl)-1-(2-methyl-6-phenylmorpholin-4-yl)ethanone;hydrochloride is sourced from PubChem (CID 120667864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).