1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane

C13H26N2O — CID 143413632

IUPAC1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane
SMILESCC.CC(=O)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C11H20N2O.C2H6/c1-10(14)12-6-8-13(9-7-12)11-4-2-3-5-11;1-2/h11H,2-9H2,1H3;1-2H3
InChIKeyGWEFNJXBBWEODO-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.12
Rot. Bonds1

About 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane

1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane (PubChem CID 143413632) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane.

Molecular Properties

Compound Name1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane
PubChem CID143413632
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane
SMILESCC.CC(=O)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C11H20N2O.C2H6/c1-10(14)12-6-8-13(9-7-12)11-4-2-3-5-11;1-2/h11H,2-9H2,1H3;1-2H3
InChIKeyGWEFNJXBBWEODO-UHFFFAOYSA-N
XLogP2.12
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-(4-piperidin-4-ylpiperazin-1-yl)ethanone
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1-[4-(4-methylpiperazin-1-yl)azepan-1-yl]ethanone
CID 146290512
(6S)-1-acetyl-4-cyclohexyl-1,4-diazepane-6-carboxamide
CID 124972494
1-acetyl-4-cyclohexyl-1,4-diazepane-6-carboxamide
CID 110098556
4-cyclopentylpiperazine-1-carboxamide
CID 57205906
methyl 4-cyclopentylpiperazine-1-carboxylate
CID 110708898
(4-cyclopentylpiperazin-1-yl)-(4-methylpiperazin-1-yl)methanone
CID 121184728
1-[4-[(1S,3R)-3-aminocyclohexyl]piperazin-1-yl]ethanone
CID 169448440
[4-(4-cyclopentylpiperazine-1-carbonyl)cyclohexyl]-(4-cyclopentylpiperazin-1-yl)methanone
CID 112815528
1,4-dicyclopentylpiperazine;oxalic acid
CID 17369822
1-(4-cyclohexylpiperazin-1-yl)propan-1-one
CID 113073042
1-(4-cycloheptylpiperazin-1-yl)-2-methylpropan-1-one
CID 59205252

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane?
The IUPAC name of 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane (CID 143413632) is 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane.
What is the SMILES notation for 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane?
The canonical SMILES for 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane is CC.CC(=O)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane?
The InChIKey is GWEFNJXBBWEODO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O.C2H6/c1-10(14)12-6-8-13(9-7-12)11-4-2-3-5-11;1-2/h11H,2-9H2,1H3;1-2H3.
What are the key properties of 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane?
1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane has a molecular weight of 226.36 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane is sourced from PubChem (CID 143413632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).