8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione

C14H22N2O3 — CID 62025169

IUPAC8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCC(=O)CCCN1C(=O)NC2(CCC(C)CC2)C1=O
InChIInChI=1S/C14H22N2O3/c1-10-5-7-14(8-6-10)12(18)16(13(19)15-14)9-3-4-11(2)17/h10H,3-9H2,1-2H3,(H,15,19)
InChIKeyARFCLSAKNCMOSM-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.86
Rot. Bonds4

About 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione

8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione (PubChem CID 62025169) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione
PubChem CID62025169
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCC(=O)CCCN1C(=O)NC2(CCC(C)CC2)C1=O
InChIInChI=1S/C14H22N2O3/c1-10-5-7-14(8-6-10)12(18)16(13(19)15-14)9-3-4-11(2)17/h10H,3-9H2,1-2H3,(H,15,19)
InChIKeyARFCLSAKNCMOSM-UHFFFAOYSA-N
XLogP1.86
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.86
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-(4-oxopentyl)-1,3-diazaspiro[4.7]dodecane-2,4-dione
CID 62019381
3-(3-hydroxypropyl)-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 43509771
3-(3-oxobutyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 60666732
3-ethyl-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 60642768
2,2-dimethyl-5-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pentanenitrile
CID 65257745
3-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-4-oxobutyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 97201760
2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetaldehyde
CID 62025356
3-[2-(azocan-1-yl)-2-oxoethyl]-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 41294447
4-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-methyl-N-(2-methylcyclohexyl)butanamide
CID 134020262
8-methyl-3-[2-(2-oxocyclopentyl)ethyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 79577135
3-[(2S)-2-hydroxy-3-[4-(3-oxobutyl)phenoxy]propyl]-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 26482215
3-(cyclohexylmethyl)-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 7170081

Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione (CID 62025169) is 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione is CC(=O)CCCN1C(=O)NC2(CCC(C)CC2)C1=O.
What is the InChIKey of 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The InChIKey is ARFCLSAKNCMOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-10-5-7-14(8-6-10)12(18)16(13(19)15-14)9-3-4-11(2)17/h10H,3-9H2,1-2H3,(H,15,19).
What are the key properties of 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione has a molecular weight of 266.34 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-(4-oxopentyl)-1,3-diazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 62025169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).