2-benzyl-2-azaspiro[3.5]nonane-3,6-dione

C15H17NO2 — CID 14964087

IUPAC2-benzyl-2-azaspiro[3.5]nonane-3,6-dione
SMILESO=C1CCCC2(C1)CN(Cc1ccccc1)C2=O
InChIInChI=1S/C15H17NO2/c17-13-7-4-8-15(9-13)11-16(14(15)18)10-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2
InChIKeyQIZOVXIZNKZINL-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.16
Rot. Bonds2

About 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione

2-benzyl-2-azaspiro[3.5]nonane-3,6-dione (PubChem CID 14964087) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione.

Molecular Properties

Compound Name2-benzyl-2-azaspiro[3.5]nonane-3,6-dione
PubChem CID14964087
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-benzyl-2-azaspiro[3.5]nonane-3,6-dione
SMILESO=C1CCCC2(C1)CN(Cc1ccccc1)C2=O
InChIInChI=1S/C15H17NO2/c17-13-7-4-8-15(9-13)11-16(14(15)18)10-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2
InChIKeyQIZOVXIZNKZINL-UHFFFAOYSA-N
XLogP2.16
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-benzyl-5-azaspiro[2.3]hexan-6-one
CID 11492070
2-benzyl-2,7-diazaspiro[3.5]nonan-3-one
CID 10421390
1'-benzylspiro[2,3-dihydro-1H-naphthalene-4,3'-azetidine]-2'-one
CID 169057699
4,6-dihydroxy-5-phenylspiro[1,2-dihydroindene-3,3'-cyclohexane]-1'-one
CID 122396113
3-benzyl-1,5-dimethyl-3-azabicyclo[3.1.0]hexan-2-one
CID 100947193
(3S)-1-benzyl-3-ethyl-3-fluoroazetidin-2-one
CID 101455407
9-benzyl-2-oxa-9-azaspiro[4.5]decane-6,8-dione
CID 163249873
5-benzyl-7-ethenyl-7-methyl-5-azaspiro[2.4]heptan-4-one
CID 67974419
2-benzyl-8-ethyl-2-azaspiro[4.5]decan-1-one
CID 126703053
(3R)-3-methyl-3-phenylcyclohexan-1-one
CID 11506594
(4R)-1-benzyl-4-hydroxy-4-methylpyrrolidin-2-one
CID 98042329
7-benzylsulfonyl-2-[(4-methoxyphenyl)methyl]-2,7-diazaspiro[3.5]nonan-3-one
CID 91909942

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione?
The IUPAC name of 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione (CID 14964087) is 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione.
What is the SMILES notation for 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione?
The canonical SMILES for 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione is O=C1CCCC2(C1)CN(Cc1ccccc1)C2=O.
What is the InChIKey of 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione?
The InChIKey is QIZOVXIZNKZINL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c17-13-7-4-8-15(9-13)11-16(14(15)18)10-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2.
What are the key properties of 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione?
2-benzyl-2-azaspiro[3.5]nonane-3,6-dione has a molecular weight of 243.31 g/mol, XLogP of 2.16, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-2-azaspiro[3.5]nonane-3,6-dione is sourced from PubChem (CID 14964087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).