1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one

C10H18N2O2 — CID 83880331

IUPAC1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one
SMILESCC(C)N1C(=O)OCC12CCNCC2
InChIInChI=1S/C10H18N2O2/c1-8(2)12-9(13)14-7-10(12)3-5-11-6-4-10/h8,11H,3-7H2,1-2H3
InChIKeyHWGKVGZTCDJATG-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.97
Rot. Bonds1

About 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one

1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one (PubChem CID 83880331) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one
PubChem CID83880331
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one
SMILESCC(C)N1C(=O)OCC12CCNCC2
InChIInChI=1S/C10H18N2O2/c1-8(2)12-9(13)14-7-10(12)3-5-11-6-4-10/h8,11H,3-7H2,1-2H3
InChIKeyHWGKVGZTCDJATG-UHFFFAOYSA-N
XLogP0.97
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Piperidin-4-yl)-1,3-oxazolidin-2-one
CID 13060627
Tert-butyl 4-amino-4-(methoxymethyl)piperidine-1-carboxylate
CID 21882533
3-(Piperidin-4-yl)-1,3-oxazolidin-2-one hydrochloride
CID 53255630
(4-Methoxymethylpiperidin-4-yl)carbamic acid tert-butyl ester
CID 67957499
tert-Butyl 4-oxa-1,9-diazaspiro[5.5]undecane-9-carboxylate
CID 67991811
Tert-butyl 4-oxa-1,9-diazaspiro[5.5]undecane-1-carboxylate
CID 82380583
Tert-butyl 9-oxa-2,6-diazaspiro(4.5)decane-2-carboxylate
CID 82386804
Tert-butyl 9-oxa-2,6-diazaspiro(4.5)decane-6-carboxylate
CID 82386805
tert-Butyl 2-oxo-3-oxa-1,8-diazaspiro[4.5]decane-8-carboxylate
CID 84805339
3-Oxa-1,8-diazaspiro(4.5)decan-2-one hydrochloride
CID 75480642
Tert-butyl 3-(morpholin-3-yl)pyrrolidine-1-carboxylate
CID 82665350
Cambridge id 5462482
CID 2846592

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one (CID 83880331) is 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one is CC(C)N1C(=O)OCC12CCNCC2.
What is the InChIKey of 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one?
The InChIKey is HWGKVGZTCDJATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-8(2)12-9(13)14-7-10(12)3-5-11-6-4-10/h8,11H,3-7H2,1-2H3.
What are the key properties of 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one?
1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one has a molecular weight of 198.27 g/mol, XLogP of 0.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-3-oxa-1,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 83880331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).