2-morpholin-2-yl-1-(3-propylphenyl)ethanone

C15H21NO2 — CID 116586299

IUPAC2-morpholin-2-yl-1-(3-propylphenyl)ethanone
SMILESCCCc1cccc(C(=O)CC2CNCCO2)c1
InChIInChI=1S/C15H21NO2/c1-2-4-12-5-3-6-13(9-12)15(17)10-14-11-16-7-8-18-14/h3,5-6,9,14,16H,2,4,7-8,10-11H2,1H3
InChIKeyUTYSKSSSBHJTNQ-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.20
Rot. Bonds5

About 2-morpholin-2-yl-1-(3-propylphenyl)ethanone

2-morpholin-2-yl-1-(3-propylphenyl)ethanone (PubChem CID 116586299) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-morpholin-2-yl-1-(3-propylphenyl)ethanone.

Molecular Properties

Compound Name2-morpholin-2-yl-1-(3-propylphenyl)ethanone
PubChem CID116586299
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name2-morpholin-2-yl-1-(3-propylphenyl)ethanone
SMILESCCCc1cccc(C(=O)CC2CNCCO2)c1
InChIInChI=1S/C15H21NO2/c1-2-4-12-5-3-6-13(9-12)15(17)10-14-11-16-7-8-18-14/h3,5-6,9,14,16H,2,4,7-8,10-11H2,1H3
InChIKeyUTYSKSSSBHJTNQ-UHFFFAOYSA-N
XLogP2.20
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-propylphenyl)-2-pyrrolidin-3-ylethanone
CID 116583457
2-morpholin-2-yl-1-(4-phenylphenyl)ethanone
CID 116586201
1-(4-chlorophenyl)-2-morpholin-2-ylethanone
CID 116586223
2-(1,3-dioxolan-2-yl)-1-(3-ethylphenyl)ethanone
CID 103543782
1-(3-fluoro-5-methylphenyl)-2-morpholin-2-ylethanone
CID 116586217
1-(4-methoxy-3,5-dimethylphenyl)-2-morpholin-2-ylethanone
CID 116919977
2-morpholin-2-yl-1-(1-propylpyrazol-4-yl)ethanone
CID 116586145
N-benzyl-2-morpholin-2-yl-N-propylacetamide
CID 66433391
1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone
CID 114736887
N-methyl-N-[(3-methylphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66429127
N-[(3-hydroxyphenyl)methyl]-N-methyl-2-morpholin-2-ylacetamide
CID 66427007
2-amino-1-(3-propylphenyl)ethanone
CID 116548428

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-2-yl-1-(3-propylphenyl)ethanone?
The IUPAC name of 2-morpholin-2-yl-1-(3-propylphenyl)ethanone (CID 116586299) is 2-morpholin-2-yl-1-(3-propylphenyl)ethanone.
What is the SMILES notation for 2-morpholin-2-yl-1-(3-propylphenyl)ethanone?
The canonical SMILES for 2-morpholin-2-yl-1-(3-propylphenyl)ethanone is CCCc1cccc(C(=O)CC2CNCCO2)c1.
What is the InChIKey of 2-morpholin-2-yl-1-(3-propylphenyl)ethanone?
The InChIKey is UTYSKSSSBHJTNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-2-4-12-5-3-6-13(9-12)15(17)10-14-11-16-7-8-18-14/h3,5-6,9,14,16H,2,4,7-8,10-11H2,1H3.
What are the key properties of 2-morpholin-2-yl-1-(3-propylphenyl)ethanone?
2-morpholin-2-yl-1-(3-propylphenyl)ethanone has a molecular weight of 247.34 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-2-yl-1-(3-propylphenyl)ethanone is sourced from PubChem (CID 116586299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).