2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone

C22H30FN3O3 — CID 42842288

IUPAC2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone
SMILESO=C(c1ccc(F)cc1)N1CCN(C(C(=O)N2CCOCC2)C2CCCC2)CC1
InChIInChI=1S/C22H30FN3O3/c23-19-7-5-18(6-8-19)21(27)25-11-9-24(10-12-25)20(17-3-1-2-4-17)22(28)26-13-15-29-16-14-26/h5-8,17,20H,1-4,9-16H2
InChIKeyYHLOJJJCEVVOBV-UHFFFAOYSA-N
MW403.50 g/mol
LogP2.00
Rot. Bonds4

About 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone

2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone (PubChem CID 42842288) has the molecular formula C22H30FN3O3 and a molecular weight of 403.50 g/mol. Its IUPAC name is 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone
PubChem CID42842288
Molecular FormulaC22H30FN3O3
Molecular Weight403.50 g/mol
Exact Mass403.23
IUPAC Name2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone
SMILESO=C(c1ccc(F)cc1)N1CCN(C(C(=O)N2CCOCC2)C2CCCC2)CC1
InChIInChI=1S/C22H30FN3O3/c23-19-7-5-18(6-8-19)21(27)25-11-9-24(10-12-25)20(17-3-1-2-4-17)22(28)26-13-15-29-16-14-26/h5-8,17,20H,1-4,9-16H2
InChIKeyYHLOJJJCEVVOBV-UHFFFAOYSA-N
XLogP2.00
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.50
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(4-fluorobenzoyl)piperazin-1-yl]ethanone
CID 46024080
2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-1-piperidin-1-ylethanone
CID 46023982
1-(4-acetylpiperazin-1-yl)-2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-2-cyclopentylethanone
CID 42842330
(4-fluorophenyl)-(1,4-oxazepan-4-yl)methanone
CID 62060048
2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-2-cyclopentyl-1-thiomorpholin-4-ylethanone
CID 46024160
(2R)-2-(4-benzoylpiperazin-1-yl)-2-cyclopentyl-N-(4-fluorophenyl)acetamide
CID 93221614
1-(4-acetylpiperazin-1-yl)-2-cyclopentyl-2-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone
CID 46024051
(2R)-2-cyclopentyl-2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-1-piperidin-1-ylethanone
CID 93208208
(2S)-2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-N-(2-piperidin-1-ylethyl)acetamide
CID 93210274
2-cyclopentyl-N-(4-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperazin-1-yl]acetamide
CID 46027386
N-benzyl-2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-N-methylacetamide
CID 42842361
2-cyclopentyl-2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-1-piperidin-1-ylethanone
CID 42842307

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone (CID 42842288) is 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone is O=C(c1ccc(F)cc1)N1CCN(C(C(=O)N2CCOCC2)C2CCCC2)CC1.
What is the InChIKey of 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone?
The InChIKey is YHLOJJJCEVVOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30FN3O3/c23-19-7-5-18(6-8-19)21(27)25-11-9-24(10-12-25)20(17-3-1-2-4-17)22(28)26-13-15-29-16-14-26/h5-8,17,20H,1-4,9-16H2.
What are the key properties of 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone?
2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone has a molecular weight of 403.50 g/mol, XLogP of 2.00, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 42842288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).