2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one

C10H18N2O3 — CID 105467611

IUPAC2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one
SMILESO=C1CC2(CCNCC2)ON1CCCO
InChIInChI=1S/C10H18N2O3/c13-7-1-6-12-9(14)8-10(15-12)2-4-11-5-3-10/h11,13H,1-8H2
InChIKeyBCEZJFAVHPXQHR-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.35
Rot. Bonds3

About 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one

2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one (PubChem CID 105467611) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one
PubChem CID105467611
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one
SMILESO=C1CC2(CCNCC2)ON1CCCO
InChIInChI=1S/C10H18N2O3/c13-7-1-6-12-9(14)8-10(15-12)2-4-11-5-3-10/h11,13H,1-8H2
InChIKeyBCEZJFAVHPXQHR-UHFFFAOYSA-N
XLogP-0.35
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one
CID 105466800
5-(3-hydroxy-2-methylpropyl)-4-oxa-5-azaspiro[2.4]heptan-6-one
CID 105441592
5-(2-oxopropyl)-4-oxa-5-azaspiro[2.4]heptan-6-one
CID 105434050
3-(2-hydroxyethyl)-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
CID 105467641
5-(piperidin-3-ylmethyl)-4-oxa-5-azaspiro[2.4]heptan-6-one
CID 105464224
3-(4-hydroxybutyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 62849673
1-(3-hydroxypropyl)piperazine-2,6-dione
CID 66062838
6-(piperidin-2-ylmethyl)-5-oxa-6-azaspiro[3.4]octan-7-one
CID 105482203
4-hydroxy-3-(2-hydroxyethyl)-1,3,8-triazaspiro[4.5]decan-2-one
CID 82098622
2-(3-hydroxypropyl)oxazinan-3-one
CID 105431183
5-(3-hydroxypropyl)-4-methyl-4,5-diazaspiro[2.4]heptan-6-one
CID 105441177
2-methyl-1,2,8-triazaspiro[4.5]decan-3-one
CID 89310977

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one?
The IUPAC name of 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one (CID 105467611) is 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one.
What is the SMILES notation for 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one?
The canonical SMILES for 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one is O=C1CC2(CCNCC2)ON1CCCO.
What is the InChIKey of 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one?
The InChIKey is BCEZJFAVHPXQHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c13-7-1-6-12-9(14)8-10(15-12)2-4-11-5-3-10/h11,13H,1-8H2.
What are the key properties of 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one?
2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one has a molecular weight of 214.26 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxypropyl)-1-oxa-2,8-diazaspiro[4.5]decan-3-one is sourced from PubChem (CID 105467611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).