3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione

C14H16N2O3 — CID 61290839

IUPAC3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
SMILESCOc1ccccc1N1C(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C14H16N2O3/c1-19-11-7-3-2-6-10(11)16-12(17)14(15-13(16)18)8-4-5-9-14/h2-3,6-7H,4-5,8-9H2,1H3,(H,15,18)
InChIKeyGGKRXKFPKXEWHO-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.06
Rot. Bonds2

About 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione

3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione (PubChem CID 61290839) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
PubChem CID61290839
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
SMILESCOc1ccccc1N1C(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C14H16N2O3/c1-19-11-7-3-2-6-10(11)16-12(17)14(15-13(16)18)8-4-5-9-14/h2-3,6-7H,4-5,8-9H2,1H3,(H,15,18)
InChIKeyGGKRXKFPKXEWHO-UHFFFAOYSA-N
XLogP2.06
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

3-(2-methoxyphenyl)-7-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 61293927
9-(2-methoxyphenyl)-7,9-diazaspiro[4.5]decane-8,10-dione
CID 115434508
10-(2-methoxyphenyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64956352
2-(2-methoxyphenyl)-2-azaspiro[4.5]decane-1,3-dione
CID 12885054
7-naphthalen-1-yl-5,7-diazaspiro[3.4]octane-6,8-dione
CID 81156365
3-[2-(2-methoxyphenyl)-2-oxoethyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 7609851
1-(2-methoxyphenyl)-1,3-diazinane-2,4,6-trione
CID 1380841
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 35798356
(3S)-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 25484865
2-(2-methoxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 2847719
3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione
CID 62819757
3-(2-methoxyphenyl)-5,5-dimethyl-1,3-oxazinane-2,4-dione
CID 134087367

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione?
The IUPAC name of 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione (CID 61290839) is 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione.
What is the SMILES notation for 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione?
The canonical SMILES for 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione is COc1ccccc1N1C(=O)NC2(CCCC2)C1=O.
What is the InChIKey of 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione?
The InChIKey is GGKRXKFPKXEWHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-19-11-7-3-2-6-10(11)16-12(17)14(15-13(16)18)8-4-5-9-14/h2-3,6-7H,4-5,8-9H2,1H3,(H,15,18).
What are the key properties of 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione?
3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione has a molecular weight of 260.29 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione is sourced from PubChem (CID 61290839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).