1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone

C14H19ClN2O2 — CID 81485233

IUPAC1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone
SMILESCC(N)C1CN(C(=O)Cc2ccccc2Cl)CCO1
InChIInChI=1S/C14H19ClN2O2/c1-10(16)13-9-17(6-7-19-13)14(18)8-11-4-2-3-5-12(11)15/h2-5,10,13H,6-9,16H2,1H3
InChIKeyHQSKSEAJEQZBAH-UHFFFAOYSA-N
MW282.77 g/mol
LogP1.46
Rot. Bonds3

About 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone

1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone (PubChem CID 81485233) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone.

Molecular Properties

Compound Name1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone
PubChem CID81485233
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone
SMILESCC(N)C1CN(C(=O)Cc2ccccc2Cl)CCO1
InChIInChI=1S/C14H19ClN2O2/c1-10(16)13-9-17(6-7-19-13)14(18)8-11-4-2-3-5-12(11)15/h2-5,10,13H,6-9,16H2,1H3
InChIKeyHQSKSEAJEQZBAH-UHFFFAOYSA-N
XLogP1.46
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2S)-2-[(1S)-1-aminoethyl]morpholin-4-yl]-2-(2-fluorophenyl)ethanone
CID 99849466
1-[2-(1-aminoethyl)morpholin-4-yl]-3-phenylpropan-1-one
CID 81424795
[(2S)-2-[(1S)-1-aminoethyl]morpholin-4-yl]-(2,3-dichlorophenyl)methanone
CID 98010838
1-[2-(1-aminoethyl)morpholin-4-yl]-2-(1,2-benzoxazol-3-yl)ethanone
CID 81485666
1-[2-(1-aminoethyl)morpholin-4-yl]-4-phenylbutan-1-one
CID 81483913
(2S)-2-amino-1-[4-[2-(2-chlorophenyl)acetyl]piperazin-1-yl]propan-1-one
CID 119306660
2-(2-chlorophenyl)-1-(3,4,5-trimethylpiperazin-1-yl)ethanone
CID 110662368
[2-(1-aminoethyl)morpholin-4-yl]-(3-chlorothiophen-2-yl)methanone
CID 115315137
1-[2-[(2S)-2-[(1R)-1-aminoethyl]morpholin-4-yl]-2-oxoethyl]-3-[(4-chlorophenyl)methyl]urea
CID 99776153
2-[2-(1-aminoethyl)morpholin-4-yl]-N-(2-chlorophenyl)acetamide
CID 81490299
2-(2-chlorophenyl)-1-(3-methylpiperazin-1-yl)ethanone
CID 65449559
[(2S)-2-[(1S)-1-aminoethyl]morpholin-4-yl]-(2-chloro-4,5-difluorophenyl)methanone
CID 99716788

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone?
The IUPAC name of 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone (CID 81485233) is 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone.
What is the SMILES notation for 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone?
The canonical SMILES for 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone is CC(N)C1CN(C(=O)Cc2ccccc2Cl)CCO1.
What is the InChIKey of 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone?
The InChIKey is HQSKSEAJEQZBAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-10(16)13-9-17(6-7-19-13)14(18)8-11-4-2-3-5-12(11)15/h2-5,10,13H,6-9,16H2,1H3.
What are the key properties of 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone?
1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone has a molecular weight of 282.77 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-aminoethyl)morpholin-4-yl]-2-(2-chlorophenyl)ethanone is sourced from PubChem (CID 81485233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).