8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone

C16H21NO2 — CID 63161441

IUPAC8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone
SMILESO=C(c1ccccc1O)N1CCC2(CCCC2)CC1
InChIInChI=1S/C16H21NO2/c18-14-6-2-1-5-13(14)15(19)17-11-9-16(10-12-17)7-3-4-8-16/h1-2,5-6,18H,3-4,7-12H2
InChIKeyKREZBZBEMVGJDB-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.19
Rot. Bonds1

About 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone

8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone (PubChem CID 63161441) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone.

Molecular Properties

Compound Name8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone
PubChem CID63161441
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone
SMILESO=C(c1ccccc1O)N1CCC2(CCCC2)CC1
InChIInChI=1S/C16H21NO2/c18-14-6-2-1-5-13(14)15(19)17-11-9-16(10-12-17)7-3-4-8-16/h1-2,5-6,18H,3-4,7-12H2
InChIKeyKREZBZBEMVGJDB-UHFFFAOYSA-N
XLogP3.19
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(9-hydroxy-3-azaspiro[5.5]undecan-3-yl)-(2-hydroxyphenyl)methanone
CID 128591808
(2-amino-3-methylphenyl)-(3-azaspiro[5.5]undecan-3-yl)methanone
CID 62936838
1-(2-hydroxybenzoyl)-4-methylpiperidine-4-carbothioamide
CID 107161017
1-(2-hydroxybenzoyl)piperidin-4-one
CID 24689914
[4-(2-bromobenzoyl)piperazin-1-yl]-(2-hydroxyphenyl)methanone
CID 108534141
3-azaspiro[5.5]undecan-3-yl-(2-hydrazinyl-3-pyridinyl)methanone
CID 62930011
8-azaspiro[4.5]decan-8-yl-(4-chloro-3-pyridinyl)methanone
CID 81226318
8-azaspiro[4.5]decan-8-yl-(2-fluoro-5-methylphenyl)methanone
CID 63159253
8-azaspiro[4.5]decan-8-yl-(2-fluoro-4-methylphenyl)methanone
CID 79796110
3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone
CID 62867411
3-azaspiro[5.5]undecan-3-yl-(2-methyl-5-sulfanylphenyl)methanone
CID 107028893
(5-amino-2-fluorophenyl)-(3-azaspiro[5.5]undecan-3-yl)methanone
CID 62938056

Frequently Asked Questions

What is the IUPAC name of 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone?
The IUPAC name of 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone (CID 63161441) is 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone.
What is the SMILES notation for 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone?
The canonical SMILES for 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone is O=C(c1ccccc1O)N1CCC2(CCCC2)CC1.
What is the InChIKey of 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone?
The InChIKey is KREZBZBEMVGJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c18-14-6-2-1-5-13(14)15(19)17-11-9-16(10-12-17)7-3-4-8-16/h1-2,5-6,18H,3-4,7-12H2.
What are the key properties of 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone?
8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone has a molecular weight of 259.35 g/mol, XLogP of 3.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azaspiro[4.5]decan-8-yl-(2-hydroxyphenyl)methanone is sourced from PubChem (CID 63161441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).