6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione

C9H14N2O3 — CID 106872094

IUPAC6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCOC1CCCCC12NC(=O)NC2=O
InChIInChI=1S/C9H14N2O3/c1-14-6-4-2-3-5-9(6)7(12)10-8(13)11-9/h6H,2-5H2,1H3,(H2,10,11,12,13)
InChIKeyITMHPXDYPXBXRD-UHFFFAOYSA-N
MW198.22 g/mol
LogP0.15
Rot. Bonds1

About 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione

6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione (PubChem CID 106872094) has the molecular formula C9H14N2O3 and a molecular weight of 198.22 g/mol. Its IUPAC name is 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione
PubChem CID106872094
Molecular FormulaC9H14N2O3
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC Name6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCOC1CCCCC12NC(=O)NC2=O
InChIInChI=1S/C9H14N2O3/c1-14-6-4-2-3-5-9(6)7(12)10-8(13)11-9/h6H,2-5H2,1H3,(H2,10,11,12,13)
InChIKeyITMHPXDYPXBXRD-UHFFFAOYSA-N
XLogP0.15
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-propan-2-yl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 115563241
(5S,9S)-9-fluoro-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 46939003
9-phenylmethoxy-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 75244463
(5R,9S)-9-(methoxymethoxymethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 124672662
6-methoxy-2-azaspiro[4.5]decane-1,3-dione
CID 106873346
(5R,9R)-9-(aminomethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 95566914
tert-butyl N-[[(5S,6R)-2,4-dioxo-1,3-diazaspiro[4.5]decan-6-yl]methyl]carbamate
CID 95566495
tert-butyl N-[[(5R,6R)-2,4-dioxo-1,3-diazaspiro[4.5]decan-6-yl]methyl]carbamate
CID 95566497
9-(methylsulfonylmethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 20798889
2-methoxycyclohexane-1,1-diamine
CID 22418278
(1R,2R,4S)-spiro[bicyclo[2.2.1]heptane-2,5'-imidazolidine]-2',4'-dione
CID 129387528
6,8,8-trimethyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 81320656

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione (CID 106872094) is 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione is COC1CCCCC12NC(=O)NC2=O.
What is the InChIKey of 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione?
The InChIKey is ITMHPXDYPXBXRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3/c1-14-6-4-2-3-5-9(6)7(12)10-8(13)11-9/h6H,2-5H2,1H3,(H2,10,11,12,13).
What are the key properties of 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione?
6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione has a molecular weight of 198.22 g/mol, XLogP of 0.15, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1,3-diazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 106872094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).