2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone

C14H18ClNO3 — CID 2961708

IUPAC2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)COc2ccccc2Cl)CC(C)O1
InChIInChI=1S/C14H18ClNO3/c1-10-7-16(8-11(2)19-10)14(17)9-18-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9H2,1-2H3
InChIKeyYDHBRJUDKBCXPX-UHFFFAOYSA-N
MW283.75 g/mol
LogP2.35
Rot. Bonds3

About 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone

2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone (PubChem CID 2961708) has the molecular formula C14H18ClNO3 and a molecular weight of 283.75 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone
PubChem CID2961708
Molecular FormulaC14H18ClNO3
Molecular Weight283.75 g/mol
Exact Mass283.10
IUPAC Name2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)COc2ccccc2Cl)CC(C)O1
InChIInChI=1S/C14H18ClNO3/c1-10-7-16(8-11(2)19-10)14(17)9-18-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9H2,1-2H3
InChIKeyYDHBRJUDKBCXPX-UHFFFAOYSA-N
XLogP2.35
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.75
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chlorophenoxy)-N-methyl-N-(1-methylpiperidin-4-yl)acetamide
CID 2422308
Acetamide, 2-(2,4-dichlorophenoxy)-N-(2-(diethylamino)ethyl)-
CID 206267
2-(2,4-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide
CID 1571645
1-[4-(2-Chlorophenoxy)butyl]piperidine
CID 2057799
2-(2-Chlorophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)propan-1-one
CID 6467230
2-(2-Chloro-4-fluorophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone
CID 6468965
1-((2-Chlorophenoxy)acetyl)piperazine
CID 3481726
4-[2-(2-Chlorophenoxy)propanoyl]morpholine
CID 3620543
2-(2,4-dichlorophenoxy)-N-(propan-2-yl)acetamide
CID 684074
1-[(4-Chlorophenoxy)acetyl]piperidine
CID 742653
1-[2-(2-Chlorophenoxy)ethyl]piperidine
CID 742763
Methyl 1-[2-(2,4-dichlorophenoxy)propanoyl]piperidine-4-carboxylate
CID 2940357

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone (CID 2961708) is 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone is CC1CN(C(=O)COc2ccccc2Cl)CC(C)O1.
What is the InChIKey of 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The InChIKey is YDHBRJUDKBCXPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO3/c1-10-7-16(8-11(2)19-10)14(17)9-18-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9H2,1-2H3.
What are the key properties of 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone has a molecular weight of 283.75 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 2961708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).