1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one

C20H35N3O2 — CID 24719804

IUPAC1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one
SMILESCC(C)C(=O)N1CCN(C(C(=O)N2CCCCC2)C2CCCC2)CC1
InChIInChI=1S/C20H35N3O2/c1-16(2)19(24)23-14-12-21(13-15-23)18(17-8-4-5-9-17)20(25)22-10-6-3-7-11-22/h16-18H,3-15H2,1-2H3
InChIKeyCYYDPUYLOJNAOF-UHFFFAOYSA-N
MW349.52 g/mol
LogP2.36
Rot. Bonds4

About 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one

1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one (PubChem CID 24719804) has the molecular formula C20H35N3O2 and a molecular weight of 349.52 g/mol. Its IUPAC name is 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one.

Molecular Properties

Compound Name1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one
PubChem CID24719804
Molecular FormulaC20H35N3O2
Molecular Weight349.52 g/mol
Exact Mass349.27
IUPAC Name1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one
SMILESCC(C)C(=O)N1CCN(C(C(=O)N2CCCCC2)C2CCCC2)CC1
InChIInChI=1S/C20H35N3O2/c1-16(2)19(24)23-14-12-21(13-15-23)18(17-8-4-5-9-17)20(25)22-10-6-3-7-11-22/h16-18H,3-15H2,1-2H3
InChIKeyCYYDPUYLOJNAOF-UHFFFAOYSA-N
XLogP2.36
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.52
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one with MolForge

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Related Compounds

1-(3-Cyclopentylpropanoyl)-4-(3-methylbutanoyl)piperazine
CID 776717
1,4-Bis(cyclohexylcarbonyl)-2,5-dimethylpiperazine
CID 2932777
1-[4-[1-[(2S)-2,6-diaminohexanoyl]piperidin-4-yl]piperidin-1-yl]pentadecan-1-one
CID 44592922
3-Cyclopentyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one
CID 806400
3-[4-(2-Cyclohexylacetyl)piperazino]-1-isopentyl-2-pyrrolidinone
CID 91925897
2-Cyclopentyl-1-[2-[(4-methylpiperidin-1-yl)methyl]azepan-1-yl]ethanone
CID 124042367
1-(4-Cyclohexylpiperazin-1-yl)-3-cyclopentylpropan-1-one
CID 787174
1-[4-(1-Cyclopentyl-2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-3-methylbutan-1-one
CID 24719217
N-tert-butyl-4-[1-cyclopentyl-2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazine-1-carboxamide
CID 24719281
1-[4-(1-Cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylbutan-1-one
CID 24719813
1-[4-(1-Cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one
CID 24719814
1-[4-[1-Cyclopentyl-2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]propan-1-one
CID 24719829

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one?
The IUPAC name of 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one (CID 24719804) is 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one.
What is the SMILES notation for 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one?
The canonical SMILES for 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one is CC(C)C(=O)N1CCN(C(C(=O)N2CCCCC2)C2CCCC2)CC1.
What is the InChIKey of 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one?
The InChIKey is CYYDPUYLOJNAOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H35N3O2/c1-16(2)19(24)23-14-12-21(13-15-23)18(17-8-4-5-9-17)20(25)22-10-6-3-7-11-22/h16-18H,3-15H2,1-2H3.
What are the key properties of 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one?
1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one has a molecular weight of 349.52 g/mol, XLogP of 2.36, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one is sourced from PubChem (CID 24719804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).