1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone

C12H14ClNO3 — CID 56878936

IUPAC1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
SMILESO=C(CO)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C12H14ClNO3/c13-10-3-1-9(2-4-10)11-7-14(5-6-17-11)12(16)8-15/h1-4,11,15H,5-8H2
InChIKeyCFVFZMMRYHYPMZ-UHFFFAOYSA-N
MW255.70 g/mol
LogP1.23
Rot. Bonds2

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

1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone (PubChem CID 56878936) has the molecular formula C12H14ClNO3 and a molecular weight of 255.70 g/mol. Its IUPAC name is 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone.

Molecular Properties

Compound Name1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
PubChem CID56878936
Molecular FormulaC12H14ClNO3
Molecular Weight255.70 g/mol
Exact Mass255.07
IUPAC Name1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
SMILESO=C(CO)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C12H14ClNO3/c13-10-3-1-9(2-4-10)11-7-14(5-6-17-11)12(16)8-15/h1-4,11,15H,5-8H2
InChIKeyCFVFZMMRYHYPMZ-UHFFFAOYSA-N
XLogP1.23
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-chlorophenyl)morpholin-4-yl]butane-1,3-dione
CID 60951251
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-pyrrolidin-1-ylethanone
CID 56741046
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-(dimethylamino)ethanone
CID 95205970
1-(4-chlorophenyl)-4-[2-(4-chlorophenyl)morpholin-4-yl]butane-1,4-dione
CID 110356660
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-morpholin-4-ylethanone
CID 56757034
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-piperidin-1-ylethanone
CID 95197348
5-amino-1-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pentan-1-one
CID 95358094
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-(1-hydroxycyclopentyl)ethanone
CID 111430703
1-[2-[4-(difluoromethoxy)phenyl]morpholin-4-yl]-2-hydroxyethanone
CID 136545989
2-anilino-1-[2-(4-chlorophenyl)morpholin-4-yl]ethanone;hydrochloride
CID 119725525
5-amino-1-[2-(4-chlorophenyl)morpholin-4-yl]hexan-1-one
CID 82849703
3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one
CID 55947512

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone?
The IUPAC name of 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone (CID 56878936) is 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone.
What is the SMILES notation for 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone?
The canonical SMILES for 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone is O=C(CO)N1CCOC(c2ccc(Cl)cc2)C1.
What is the InChIKey of 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone?
The InChIKey is CFVFZMMRYHYPMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClNO3/c13-10-3-1-9(2-4-10)11-7-14(5-6-17-11)12(16)8-15/h1-4,11,15H,5-8H2.
What are the key properties of 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone?
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone has a molecular weight of 255.70 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone is sourced from PubChem (CID 56878936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).