cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone

C15H26N2O2 — CID 131899076

IUPACcyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone
SMILESO=C(C1CCC1)N1CCN(CCC2CCOC2)CC1
InChIInChI=1S/C15H26N2O2/c18-15(14-2-1-3-14)17-9-7-16(8-10-17)6-4-13-5-11-19-12-13/h13-14H,1-12H2
InChIKeyTVRBVLQLAKPUAI-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.36
Rot. Bonds4

About cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone

cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone (PubChem CID 131899076) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone
PubChem CID131899076
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Namecyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone
SMILESO=C(C1CCC1)N1CCN(CCC2CCOC2)CC1
InChIInChI=1S/C15H26N2O2/c18-15(14-2-1-3-14)17-9-7-16(8-10-17)6-4-13-5-11-19-12-13/h13-14H,1-12H2
InChIKeyTVRBVLQLAKPUAI-UHFFFAOYSA-N
XLogP1.36
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-aminocyclohexyl)-[4-(oxolan-3-ylmethyl)piperazin-1-yl]methanone;dihydrochloride
CID 119897515
[4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 94191646
[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]-(oxolan-3-yl)methanone
CID 55204831
[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]-pyrrolidin-1-ylmethanone
CID 138807507
cyclopentyl-[3-[4-[[(3R)-oxolan-3-yl]methyl]piperazin-1-yl]sulfonylazetidin-1-yl]methanone
CID 97348653
cyclobutyl-(4-pentylpiperazin-1-yl)methanone
CID 113075121
cyclopentyl-[3-(oxolan-3-ylmethoxy)azetidin-1-yl]methanone
CID 134160596
cyclobutyl-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 113073602
3-[4-(cyclobutanecarbonyl)piperazin-1-yl]-1-piperidin-1-ylpropan-1-one
CID 110665012
1,3-benzodioxol-5-yl-[4-[2-(oxolan-3-yl)ethyl]-1,4-diazepan-1-yl]methanone
CID 137340675
1-[4-(cyclohexanecarbonyl)piperazin-1-yl]-3-morpholin-4-ylpropan-1-one
CID 110422617
2-[4-(oxolane-3-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone
CID 86850684

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone?
The IUPAC name of cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone (CID 131899076) is cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone.
What is the SMILES notation for cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone?
The canonical SMILES for cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone is O=C(C1CCC1)N1CCN(CCC2CCOC2)CC1.
What is the InChIKey of cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone?
The InChIKey is TVRBVLQLAKPUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c18-15(14-2-1-3-14)17-9-7-16(8-10-17)6-4-13-5-11-19-12-13/h13-14H,1-12H2.
What are the key properties of cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone?
cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone has a molecular weight of 266.38 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone is sourced from PubChem (CID 131899076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).