2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone

C15H20ClNO2 — CID 106867039

IUPAC2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone
SMILESCCN1CCOC(C(=O)Cc2ccc(C)cc2Cl)C1
InChIInChI=1S/C15H20ClNO2/c1-3-17-6-7-19-15(10-17)14(18)9-12-5-4-11(2)8-13(12)16/h4-5,8,15H,3,6-7,9-10H2,1-2H3
InChIKeyAMFPJBRFXDRNAD-UHFFFAOYSA-N
MW281.78 g/mol
LogP2.48
Rot. Bonds4

About 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone

2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone (PubChem CID 106867039) has the molecular formula C15H20ClNO2 and a molecular weight of 281.78 g/mol. Its IUPAC name is 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone.

Molecular Properties

Compound Name2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone
PubChem CID106867039
Molecular FormulaC15H20ClNO2
Molecular Weight281.78 g/mol
Exact Mass281.12
IUPAC Name2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone
SMILESCCN1CCOC(C(=O)Cc2ccc(C)cc2Cl)C1
InChIInChI=1S/C15H20ClNO2/c1-3-17-6-7-19-15(10-17)14(18)9-12-5-4-11(2)8-13(12)16/h4-5,8,15H,3,6-7,9-10H2,1-2H3
InChIKeyAMFPJBRFXDRNAD-UHFFFAOYSA-N
XLogP2.48
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.78
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-4-methylphenyl)-1-(4-propan-2-ylmorpholin-2-yl)ethanone
CID 106867043
1-(4-ethylmorpholin-2-yl)-2-(4-methylphenyl)ethanone
CID 79666250
1-(4-ethylmorpholin-2-yl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 114347306
2-(2-bromo-4-fluorophenyl)-1-(4-ethylmorpholin-2-yl)ethanone
CID 79667003
1-(4-ethylmorpholin-2-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 79666582
(3,5-dimethylphenyl)-(4-ethylmorpholin-2-yl)methanone
CID 79667186
2-(3,4-dichlorophenyl)-1-(4-propylmorpholin-2-yl)ethanone
CID 79669702
2-[4-[(2-chloro-4-methylphenyl)methyl]morpholin-2-yl]acetic acid
CID 106865290
2-(3,5-dimethylphenyl)-1-(4-propylmorpholin-2-yl)ethanone
CID 79668855
2-(2-chloro-4-methylphenyl)-1-(oxan-4-yl)ethanone
CID 106865356
2-(2-chloro-4-methylphenyl)-1-(2-methyloxolan-3-yl)ethanone
CID 106865766
(4-ethylmorpholin-2-yl)-(3-fluoro-5-methylphenyl)methanone
CID 79705374

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone?
The IUPAC name of 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone (CID 106867039) is 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone.
What is the SMILES notation for 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone?
The canonical SMILES for 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone is CCN1CCOC(C(=O)Cc2ccc(C)cc2Cl)C1.
What is the InChIKey of 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone?
The InChIKey is AMFPJBRFXDRNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO2/c1-3-17-6-7-19-15(10-17)14(18)9-12-5-4-11(2)8-13(12)16/h4-5,8,15H,3,6-7,9-10H2,1-2H3.
What are the key properties of 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone?
2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone has a molecular weight of 281.78 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methylphenyl)-1-(4-ethylmorpholin-2-yl)ethanone is sourced from PubChem (CID 106867039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).