2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone

C17H22FNO2 — CID 94823425

IUPAC2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
SMILESO=C(CC1CCCC1)N1CCO[C@@H](c2ccc(F)cc2)C1
InChIInChI=1S/C17H22FNO2/c18-15-7-5-14(6-8-15)16-12-19(9-10-21-16)17(20)11-13-3-1-2-4-13/h5-8,13,16H,1-4,9-12H2/t16-/m1/s1
InChIKeyJQSVZMCHHOJAFB-MRXNPFEDSA-N
MW291.37 g/mol
LogP3.31
Rot. Bonds3

About 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone

2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone (PubChem CID 94823425) has the molecular formula C17H22FNO2 and a molecular weight of 291.37 g/mol. Its IUPAC name is 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
PubChem CID94823425
Molecular FormulaC17H22FNO2
Molecular Weight291.37 g/mol
Exact Mass291.16
IUPAC Name2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
SMILESO=C(CC1CCCC1)N1CCO[C@@H](c2ccc(F)cc2)C1
InChIInChI=1S/C17H22FNO2/c18-15-7-5-14(6-8-15)16-12-19(9-10-21-16)17(20)11-13-3-1-2-4-13/h5-8,13,16H,1-4,9-12H2/t16-/m1/s1
InChIKeyJQSVZMCHHOJAFB-MRXNPFEDSA-N
XLogP3.31
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-1-[2-(4-methylphenyl)morpholin-4-yl]ethanone
CID 121134744
2-chloro-1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 51889846
3-[2-(4-fluorophenyl)morpholin-4-yl]-3-oxopropanoic acid
CID 62231452
1-(2-phenylmorpholin-4-yl)-2-piperidin-3-ylethanone
CID 62676153
2-(4-fluoroanilino)-1-[2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 146126544
3-(cyclopropylamino)-1-[2-(4-fluorophenyl)morpholin-4-yl]propan-1-one
CID 60964272
2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone
CID 124987741
1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-2-[(2R)-2-[(2S)-2-hydroxypropyl]piperidin-1-yl]ethanone
CID 124864293
1-[2-(4-fluorophenyl)morpholin-4-yl]-3-methylsulfonylpropan-1-one
CID 131913070
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 110364011
6-amino-1-[2-(4-fluorophenyl)morpholin-4-yl]hexan-1-one
CID 60963489
1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-2-(2-methylphenyl)ethanone
CID 38372872

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone?
The IUPAC name of 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone (CID 94823425) is 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone.
What is the SMILES notation for 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone?
The canonical SMILES for 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone is O=C(CC1CCCC1)N1CCO[C@@H](c2ccc(F)cc2)C1.
What is the InChIKey of 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone?
The InChIKey is JQSVZMCHHOJAFB-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H22FNO2/c18-15-7-5-14(6-8-15)16-12-19(9-10-21-16)17(20)11-13-3-1-2-4-13/h5-8,13,16H,1-4,9-12H2/t16-/m1/s1.
What are the key properties of 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone?
2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone has a molecular weight of 291.37 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone is sourced from PubChem (CID 94823425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).