1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one

C10H16N2O2 — CID 83879909

IUPAC1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one
SMILESO=C1OCC2(CCNC2)N1C1CCC1
InChIInChI=1S/C10H16N2O2/c13-9-12(8-2-1-3-8)10(7-14-9)4-5-11-6-10/h8,11H,1-7H2
InChIKeyZNBITRCJTITSKB-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.72
Rot. Bonds1

About 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one

1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one (PubChem CID 83879909) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one.

Molecular Properties

Compound Name1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one
PubChem CID83879909
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one
SMILESO=C1OCC2(CCNC2)N1C1CCC1
InChIInChI=1S/C10H16N2O2/c13-9-12(8-2-1-3-8)10(7-14-9)4-5-11-6-10/h8,11H,1-7H2
InChIKeyZNBITRCJTITSKB-UHFFFAOYSA-N
XLogP0.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Oxa-1,7-diazaspiro[4.4]nonan-2-one hydrochloride
CID 146675782
1-(2,2,2-Trifluoroethyl)-3-oxa-1,7-diazaspiro[4.4]nonan-2-one
CID 83891547
4-propan-2-yl-3-[[(2S)-pyrrolidin-2-yl]methyl]-1,3-oxazolidin-2-one
CID 70970968
1,1-Dimethylethyl (3S)-3-[(3R)-tetrahydrofuran-3-ylamino]pyrrolidine-1-carboxylate
CID 86609372
4-Methyl-4-(1-pyrrolidin-1-ylethyl)-1,3-oxazolidin-2-one;hydrochloride
CID 173062264
tert-butyl N-[3-(methoxymethyl)pyrrolidin-3-yl]-N-methylcarbamate
CID 176262373
tert-butyl (3S)-3-(methoxymethyl)-3-(methylamino)pyrrolidine-1-carboxylate
CID 177292940
7-Methyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one
CID 65585123
7-Propan-2-yl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one
CID 65586388
7-Cyclopropyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one
CID 65586397
4-Methyl-4-(1-pyrrolidin-1-ylethyl)-1,3-oxazolidin-2-one
CID 67309448
3-Oxa-1,7-diazaspiro[4.4]nonan-2-one
CID 71669039

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one?
The IUPAC name of 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one (CID 83879909) is 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one.
What is the SMILES notation for 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one?
The canonical SMILES for 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one is O=C1OCC2(CCNC2)N1C1CCC1.
What is the InChIKey of 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one?
The InChIKey is ZNBITRCJTITSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c13-9-12(8-2-1-3-8)10(7-14-9)4-5-11-6-10/h8,11H,1-7H2.
What are the key properties of 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one?
1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one has a molecular weight of 196.25 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-oxa-1,7-diazaspiro[4.4]nonan-2-one is sourced from PubChem (CID 83879909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).