N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide

C15H19NO4 — CID 47249822

IUPACN-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide
SMILESO=C(NC1CCC2(CC1)OCCO2)c1ccccc1O
InChIInChI=1S/C15H19NO4/c17-13-4-2-1-3-12(13)14(18)16-11-5-7-15(8-6-11)19-9-10-20-15/h1-4,11,17H,5-10H2,(H,16,18)
InChIKeyOTKKFMQGYLBGTL-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.81
Rot. Bonds2

About N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide

N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide (PubChem CID 47249822) has the molecular formula C15H19NO4 and a molecular weight of 277.32 g/mol. Its IUPAC name is N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide
PubChem CID47249822
Molecular FormulaC15H19NO4
Molecular Weight277.32 g/mol
Exact Mass277.13
IUPAC NameN-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide
SMILESO=C(NC1CCC2(CC1)OCCO2)c1ccccc1O
InChIInChI=1S/C15H19NO4/c17-13-4-2-1-3-12(13)14(18)16-11-5-7-15(8-6-11)19-9-10-20-15/h1-4,11,17H,5-10H2,(H,16,18)
InChIKeyOTKKFMQGYLBGTL-UHFFFAOYSA-N
XLogP1.81
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-fluorobenzamide
CID 112729579
4-bromo-N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide
CID 78980766
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-methylpyridine-3-carboxamide
CID 78950976
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-fluoro-6-hydroxybenzamide
CID 104916913
N-(1,4-dioxaspiro[4.5]decan-8-yl)-5-fluoro-2-methylbenzamide
CID 112729639
2-hydroxy-N-(4-oxocyclohexyl)benzamide
CID 43652857
1-(2-chlorophenyl)-3-(1,4-dioxaspiro[4.5]decan-8-yl)urea
CID 112729526
N-(1,4-dioxaspiro[4.5]decan-8-yl)pyrimidine-5-carboxamide
CID 104626056
2-bromo-N-[(7S)-1,4-dioxaspiro[4.5]decan-7-yl]benzamide
CID 124737942
N-(1,4-dioxaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carboxamide
CID 112729640
4-(dimethylamino)-N-(1,4-dioxaspiro[4.5]decan-8-yl)-3-fluorobenzamide
CID 71936290
3-chloro-N-(1,4-dioxaspiro[4.5]decan-8-yl)-4-fluorobenzamide
CID 81422797

Frequently Asked Questions

What is the IUPAC name of N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide?
The IUPAC name of N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide (CID 47249822) is N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide.
What is the SMILES notation for N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide?
The canonical SMILES for N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide is O=C(NC1CCC2(CC1)OCCO2)c1ccccc1O.
What is the InChIKey of N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide?
The InChIKey is OTKKFMQGYLBGTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO4/c17-13-4-2-1-3-12(13)14(18)16-11-5-7-15(8-6-11)19-9-10-20-15/h1-4,11,17H,5-10H2,(H,16,18).
What are the key properties of N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide?
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide has a molecular weight of 277.32 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-hydroxybenzamide is sourced from PubChem (CID 47249822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).