[(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone

C16H22N2O3 — CID 124694261

IUPAC[(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone
SMILESC[C@@H]1CN(C(=O)[C@@H]2CNCCO2)[C@@H](c2ccccc2)CO1
InChIInChI=1S/C16H22N2O3/c1-12-10-18(16(19)15-9-17-7-8-20-15)14(11-21-12)13-5-3-2-4-6-13/h2-6,12,14-15,17H,7-11H2,1H3/t12-,14-,15+/m1/s1
InChIKeyHPNMHUNNXMMLIU-YUELXQCFSA-N
MW290.36 g/mol
LogP0.96
Rot. Bonds2

About [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone

[(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone (PubChem CID 124694261) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone.

Molecular Properties

Compound Name[(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone
PubChem CID124694261
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name[(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone
SMILESC[C@@H]1CN(C(=O)[C@@H]2CNCCO2)[C@@H](c2ccccc2)CO1
InChIInChI=1S/C16H22N2O3/c1-12-10-18(16(19)15-9-17-7-8-20-15)14(11-21-12)13-5-3-2-4-6-13/h2-6,12,14-15,17H,7-11H2,1H3/t12-,14-,15+/m1/s1
InChIKeyHPNMHUNNXMMLIU-YUELXQCFSA-N
XLogP0.96
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone with MolForge

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

Launch Full Analysis

Related Compounds

(2-methyl-5-phenylmorpholin-4-yl)-(oxiran-2-yl)methanone
CID 154879876
1-(morpholine-2-carbonyl)-7-phenyl-1,4-diazepan-5-one;hydrochloride
CID 119736164
1-(2-methyl-5-phenylmorpholin-4-yl)-3-piperidin-4-ylbutan-1-one;hydrochloride
CID 119804151
1-[(2S,5S)-2-methyl-5-phenylmorpholin-4-yl]-2-pyrimidin-5-ylethanone
CID 124882003
[5-methyl-2-(2-methylphenyl)morpholin-4-yl]-morpholin-2-ylmethanone
CID 119798520
2-(methylamino)-1-[(2S,5S)-2-methyl-5-phenylmorpholin-4-yl]ethanone
CID 124686301
(2S)-2-amino-1-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]butan-1-one
CID 124890111
(3-ethyl-4-phenylpiperidin-1-yl)-morpholin-2-ylmethanone
CID 119817683
(3-hydroxy-2-pyridinyl)-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]methanone
CID 124572458
[2-(3-methylphenyl)azepan-1-yl]-morpholin-2-ylmethanone
CID 119792785
4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine
CID 142383852
[2-(3-methylphenyl)azepan-1-yl]-morpholin-2-ylmethanone;hydrochloride
CID 119792784

Frequently Asked Questions

What is the IUPAC name of [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone?
The IUPAC name of [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone (CID 124694261) is [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone.
What is the SMILES notation for [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone?
The canonical SMILES for [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone is C[C@@H]1CN(C(=O)[C@@H]2CNCCO2)[C@@H](c2ccccc2)CO1.
What is the InChIKey of [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone?
The InChIKey is HPNMHUNNXMMLIU-YUELXQCFSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-12-10-18(16(19)15-9-17-7-8-20-15)14(11-21-12)13-5-3-2-4-6-13/h2-6,12,14-15,17H,7-11H2,1H3/t12-,14-,15+/m1/s1.
What are the key properties of [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone?
[(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone has a molecular weight of 290.36 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone is sourced from PubChem (CID 124694261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).