cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone

C13H22N2O2 — CID 97372311

IUPACcyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone
SMILESO=C(C1CCC1)N1CCC2(CC1)CNCCO2
InChIInChI=1S/C13H22N2O2/c16-12(11-2-1-3-11)15-7-4-13(5-8-15)10-14-6-9-17-13/h11,14H,1-10H2
InChIKeyBQPUESFRLCTNAD-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.77
Rot. Bonds1

About cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone

cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone (PubChem CID 97372311) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone.

Molecular Properties

Compound Namecyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone
PubChem CID97372311
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Namecyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone
SMILESO=C(C1CCC1)N1CCC2(CC1)CNCCO2
InChIInChI=1S/C13H22N2O2/c16-12(11-2-1-3-11)15-7-4-13(5-8-15)10-14-6-9-17-13/h11,14H,1-10H2
InChIKeyBQPUESFRLCTNAD-UHFFFAOYSA-N
XLogP0.77
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-Piperidinylcarbonyl)Morpholine
CID 1520211
4-(Piperidine-4-carbonyl)morpholine hydrochloride
CID 2794689
Cyclopropyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone
CID 97372310
Cyclopropyl(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone
CID 97449215
N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
CID 5157518
4-(Piperidin-3-ylcarbonyl)morpholine
CID 16227662
N-[3-(morpholin-4-yl)propyl]piperidine-4-carboxamide dihydrochloride
CID 45791534
N-[4-[9-(4-aminobutanoyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-4-oxobutyl]acetamide
CID 134791130
N-[3-(morpholin-4-yl)propyl]cyclobutanecarboxamide
CID 17217277
Cyclobutyl-[4-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
CID 49096036
Cyclopropyl(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone;hydrochloride
CID 118742018
(2,6-Dimethylmorpholin-4-yl)-(4-methoxypiperidin-4-yl)methanone
CID 119669794

Frequently Asked Questions

What is the IUPAC name of cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone?
The IUPAC name of cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone (CID 97372311) is cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone.
What is the SMILES notation for cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone?
The canonical SMILES for cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone is O=C(C1CCC1)N1CCC2(CC1)CNCCO2.
What is the InChIKey of cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone?
The InChIKey is BQPUESFRLCTNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c16-12(11-2-1-3-11)15-7-4-13(5-8-15)10-14-6-9-17-13/h11,14H,1-10H2.
What are the key properties of cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone?
cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone has a molecular weight of 238.33 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone is sourced from PubChem (CID 97372311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).