2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone

C15H22N2O2 — CID 170895902

IUPAC2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone
SMILESCC1C(c2ccccc2)OCCN1C(=O)CN(C)C
InChIInChI=1S/C15H22N2O2/c1-12-15(13-7-5-4-6-8-13)19-10-9-17(12)14(18)11-16(2)3/h4-8,12,15H,9-11H2,1-3H3
InChIKeyUJFQKSJHFLFHQV-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.54
Rot. Bonds3

About 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone

2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone (PubChem CID 170895902) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone
PubChem CID170895902
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone
SMILESCC1C(c2ccccc2)OCCN1C(=O)CN(C)C
InChIInChI=1S/C15H22N2O2/c1-12-15(13-7-5-4-6-8-13)19-10-9-17(12)14(18)11-16(2)3/h4-8,12,15H,9-11H2,1-3H3
InChIKeyUJFQKSJHFLFHQV-UHFFFAOYSA-N
XLogP1.54
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2R,3S)-3-methyl-2-phenylmorpholin-4-yl]-4-[(2R,3R)-3-methyl-2-phenylmorpholin-4-yl]butane-1,4-dione
CID 40782270
1-(3-methyl-2-phenylmorpholin-4-yl)propan-1-one
CID 110728423
1-[(2S,3R)-3-methyl-2-phenylmorpholin-4-yl]ethanone
CID 92843868
2-(3-methylphenoxy)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone
CID 110728463
(3-methyl-2-phenylmorpholin-4-yl)-(oxolan-2-yl)methanone
CID 110728429
butanedioic acid;(2S,3S)-3,4-dimethyl-2-phenylmorpholine
CID 76960510
(4-methoxyphenyl)-(3-methyl-2-phenylmorpholin-4-yl)methanone
CID 110728442
2-[cyclopentyl(methyl)amino]-1-[(2S,3R)-2-(hydroxymethyl)-3-phenylmorpholin-4-yl]ethanone
CID 134704253
1-[(2R)-2-benzylmorpholin-4-yl]-2-(dimethylamino)ethanone
CID 124615413
2,3-dihydroxybutanedioic acid;(2S,3S)-3,4-dimethyl-2-phenylmorpholine;hydrate
CID 173400053
(2S,3S)-3,4-dimethyl-2-phenylmorpholine;hydron;chloride
CID 50986664
3-methyl-2-phenyl-4-propylsulfonylmorpholine
CID 110728469

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone (CID 170895902) is 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone is CC1C(c2ccccc2)OCCN1C(=O)CN(C)C.
What is the InChIKey of 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone?
The InChIKey is UJFQKSJHFLFHQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12-15(13-7-5-4-6-8-13)19-10-9-17(12)14(18)11-16(2)3/h4-8,12,15H,9-11H2,1-3H3.
What are the key properties of 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone?
2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone has a molecular weight of 262.35 g/mol, XLogP of 1.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-(3-methyl-2-phenylmorpholin-4-yl)ethanone is sourced from PubChem (CID 170895902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).