4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one

C14H22N2O3 — CID 110198011

IUPAC4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one
SMILESCCN1C(=O)CN(C(=O)C2CC2)CC12CCOCC2
InChIInChI=1S/C14H22N2O3/c1-2-16-12(17)9-15(13(18)11-3-4-11)10-14(16)5-7-19-8-6-14/h11H,2-10H2,1H3
InChIKeyZTPHFPJLRYZPKI-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.64
Rot. Bonds2

About 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one

4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one (PubChem CID 110198011) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one.

Molecular Properties

Compound Name4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one
PubChem CID110198011
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one
SMILESCCN1C(=O)CN(C(=O)C2CC2)CC12CCOCC2
InChIInChI=1S/C14H22N2O3/c1-2-16-12(17)9-15(13(18)11-3-4-11)10-14(16)5-7-19-8-6-14/h11H,2-10H2,1H3
InChIKeyZTPHFPJLRYZPKI-UHFFFAOYSA-N
XLogP0.64
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Ethyl-4-(3-methylbutanoyl)-9-oxa-1,4-diazaspiro[5.5]undecan-2-one
CID 110198010
4-(Cyclobutanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one
CID 110198012
4-(Cyclopentanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one
CID 110198013
1-Ethyl-4-propanoyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one
CID 110198015
Cyclopropyl-(7-ethyl-3-oxa-7,11-diazaspiro[5.6]dodecan-11-yl)methanone
CID 110198029
(4-Methyl-1-piperazinyl)(tetrahydro-2H-pyran-4-yl)methanone
CID 58723487
1-(Oxane-4-carbonyl)-4-(propan-2-yl)piperazine
CID 60432341
1-Tert-butyl-4-(3-oxabicyclo[3.1.0]hexan-6-yl)-3-oxopiperazin-1-ium-1-carboxylate
CID 87262809
(4-Ethylpiperazin-1-yl)-(oxan-4-yl)methanone
CID 110690014
(4-Tert-butylpiperazin-1-yl)-(oxan-4-yl)methanone
CID 113074848
1-[4-(Oxan-4-ylmethyl)piperazin-1-yl]propan-1-one
CID 129177919
4-(dimethylamino)-N-methyl-N-propan-2-yloxane-4-carboxamide
CID 134505355

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one?
The IUPAC name of 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one (CID 110198011) is 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one.
What is the SMILES notation for 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one?
The canonical SMILES for 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one is CCN1C(=O)CN(C(=O)C2CC2)CC12CCOCC2.
What is the InChIKey of 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one?
The InChIKey is ZTPHFPJLRYZPKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-2-16-12(17)9-15(13(18)11-3-4-11)10-14(16)5-7-19-8-6-14/h11H,2-10H2,1H3.
What are the key properties of 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one?
4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one has a molecular weight of 266.34 g/mol, XLogP of 0.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropanecarbonyl)-1-ethyl-9-oxa-1,4-diazaspiro[5.5]undecan-2-one is sourced from PubChem (CID 110198011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).