2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone

C10H18N2O2 — CID 82505839

IUPAC2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone
SMILESO=C(CC1(O)CCC1)N1CCNCC1
InChIInChI=1S/C10H18N2O2/c13-9(8-10(14)2-1-3-10)12-6-4-11-5-7-12/h11,14H,1-8H2
InChIKeyCYIBWPHUGYVKGV-UHFFFAOYSA-N
MW198.27 g/mol
LogP-0.28
Rot. Bonds2

About 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone

2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone (PubChem CID 82505839) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone.

Molecular Properties

Compound Name2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone
PubChem CID82505839
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone
SMILESO=C(CC1(O)CCC1)N1CCNCC1
InChIInChI=1S/C10H18N2O2/c13-9(8-10(14)2-1-3-10)12-6-4-11-5-7-12/h11,14H,1-8H2
InChIKeyCYIBWPHUGYVKGV-UHFFFAOYSA-N
XLogP-0.28
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(1-hydroxycyclohexyl)acetyl] piperazine-1-carboxylate
CID 174524646
2-cyclohexyl-1-[4-[2-(1-hydroxycyclopentyl)acetyl]piperazin-1-yl]ethanone
CID 111537735
2-[(1-hydroxycyclohexyl)methyl-methylamino]-1-piperazin-1-ylethanone
CID 65213919
2-(4-hydroxypiperidin-4-yl)-1-(2-propan-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone
CID 177010300
1-(3,9-diazaspiro[5.5]undecan-3-yl)-2-(4-hydroxy-1-propan-2-ylpiperidin-4-yl)ethanone
CID 177010579
2-(4-hydroxy-1-methylpiperidin-4-yl)-1-piperidin-1-ylethanone
CID 175786218
1-(piperazin-1-ylmethyl)cyclobutan-1-ol
CID 82503232
1-piperazin-1-yl-2-(thietan-3-yl)ethanone
CID 84669595
1-[4-[2-(1-hydroxycyclopentyl)acetyl]piperazin-1-yl]-2-(4-methylphenyl)ethanone
CID 111432626
2-[1-[2-(1-hydroxycyclopentyl)acetyl]piperidin-4-yl]-N,N-dimethylacetamide
CID 110028300
1,10-di(piperazin-1-yl)decane-1,10-dione
CID 19981244
1-piperazin-1-yl-2-pyrrolidin-1-ylethanone
CID 13057079

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone?
The IUPAC name of 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone (CID 82505839) is 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone.
What is the SMILES notation for 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone?
The canonical SMILES for 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone is O=C(CC1(O)CCC1)N1CCNCC1.
What is the InChIKey of 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone?
The InChIKey is CYIBWPHUGYVKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c13-9(8-10(14)2-1-3-10)12-6-4-11-5-7-12/h11,14H,1-8H2.
What are the key properties of 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone?
2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone has a molecular weight of 198.27 g/mol, XLogP of -0.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclobutyl)-1-piperazin-1-ylethanone is sourced from PubChem (CID 82505839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).