[(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone

C17H22ClNO2 — CID 95123744

IUPAC[(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone
SMILESO=C(C1CCCC1)N1CCO[C@H](Cc2ccccc2Cl)C1
InChIInChI=1S/C17H22ClNO2/c18-16-8-4-3-7-14(16)11-15-12-19(9-10-21-15)17(20)13-5-1-2-6-13/h3-4,7-8,13,15H,1-2,5-6,9-12H2/t15-/m1/s1
InChIKeyFYVAALJDZKBIAU-OAHLLOKOSA-N
MW307.82 g/mol
LogP3.30
Rot. Bonds3

About [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone

[(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone (PubChem CID 95123744) has the molecular formula C17H22ClNO2 and a molecular weight of 307.82 g/mol. Its IUPAC name is [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone.

Molecular Properties

Compound Name[(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone
PubChem CID95123744
Molecular FormulaC17H22ClNO2
Molecular Weight307.82 g/mol
Exact Mass307.13
IUPAC Name[(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone
SMILESO=C(C1CCCC1)N1CCO[C@H](Cc2ccccc2Cl)C1
InChIInChI=1S/C17H22ClNO2/c18-16-8-4-3-7-14(16)11-15-12-19(9-10-21-15)17(20)13-5-1-2-6-13/h3-4,7-8,13,15H,1-2,5-6,9-12H2/t15-/m1/s1
InChIKeyFYVAALJDZKBIAU-OAHLLOKOSA-N
XLogP3.30
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.82
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[(2-chlorophenyl)methyl]morpholin-4-yl]-2-[methyl(piperidin-4-yl)amino]ethanone
CID 56874173
methyl 4-[(2R)-2-[(2-chlorophenyl)methyl]morpholine-4-carbonyl]benzoate
CID 26327707
cyclobutyl-[2-(2,2-diphenylethyl)morpholin-4-yl]methanone
CID 45196089
[2-[(2-chlorophenyl)methyl]morpholin-4-yl]-(4-methyl-1,3-thiazol-5-yl)methanone
CID 102604292
[(2R)-2-[(3-chlorophenyl)methyl]morpholin-4-yl]-(oxan-4-yl)methanone
CID 124961439
3-[2-[2-[(2-chlorophenyl)methyl]morpholin-4-yl]-2-oxoethyl]oxadiazol-3-ium-5-olate
CID 45228933
ethyl 4-[(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]piperidine-1-carboxylate
CID 28769517
2-[(2S)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]ethanol
CID 125000372
[(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-(3-fluoro-2-methoxyphenyl)methanone
CID 95552061
1-[2-[(2-chlorophenyl)methyl]morpholin-4-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone
CID 45185358
cyclopentyl-[(2R)-2-(fluoromethyl)-1,4-oxazepan-4-yl]methanone
CID 129349008
cyclopentyl-[2-(2-fluorophenyl)morpholin-4-yl]methanone
CID 71684127

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone?
The IUPAC name of [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone (CID 95123744) is [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone.
What is the SMILES notation for [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone?
The canonical SMILES for [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone is O=C(C1CCCC1)N1CCO[C@H](Cc2ccccc2Cl)C1.
What is the InChIKey of [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone?
The InChIKey is FYVAALJDZKBIAU-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H22ClNO2/c18-16-8-4-3-7-14(16)11-15-12-19(9-10-21-15)17(20)13-5-1-2-6-13/h3-4,7-8,13,15H,1-2,5-6,9-12H2/t15-/m1/s1.
What are the key properties of [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone?
[(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone has a molecular weight of 307.82 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-[(2-chlorophenyl)methyl]morpholin-4-yl]-cyclopentylmethanone is sourced from PubChem (CID 95123744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).