2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one

C15H20N2O2 — CID 59317131

IUPAC2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one
SMILESCOCc1ccc(C2NC3(CCCC3)NC2=O)cc1
InChIInChI=1S/C15H20N2O2/c1-19-10-11-4-6-12(7-5-11)13-14(18)17-15(16-13)8-2-3-9-15/h4-7,13,16H,2-3,8-10H2,1H3,(H,17,18)
InChIKeyUROQJYCFOZYMNL-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.86
Rot. Bonds3

About 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one

2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one (PubChem CID 59317131) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one.

Molecular Properties

Compound Name2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one
PubChem CID59317131
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one
SMILESCOCc1ccc(C2NC3(CCCC3)NC2=O)cc1
InChIInChI=1S/C15H20N2O2/c1-19-10-11-4-6-12(7-5-11)13-14(18)17-15(16-13)8-2-3-9-15/h4-7,13,16H,2-3,8-10H2,1H3,(H,17,18)
InChIKeyUROQJYCFOZYMNL-UHFFFAOYSA-N
XLogP1.86
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one
CID 97179322
3-ethyl-4-[4-(methoxymethyl)phenyl]piperidine-2,6-dione
CID 79320679
(2S)-2-(3-bromophenyl)-1,4-diazaspiro[4.4]nonan-3-one
CID 86334224
(1R,5S)-3-[4-(methoxymethyl)phenyl]-8-azabicyclo[3.2.1]octane
CID 58503455
1-[4-(methoxymethyl)phenyl]cyclopentan-1-amine
CID 117294034
4-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[[4-(methoxymethyl)phenyl]methyl]butanamide
CID 55615122
5-[[4-(methoxymethyl)phenyl]methyl]-5-propan-2-ylpyrrolidin-2-one
CID 104687889
5-ethyl-5-[[4-(methoxymethyl)phenyl]methyl]pyrrolidin-2-one
CID 113441378
(2S)-2-(4-bromo-2-fluorophenyl)-1,4-diazaspiro[4.4]nonan-3-one
CID 86334216
1-(1-isocyanatocyclopentyl)-4-(methoxymethyl)benzene
CID 117334446
N-[[4-(methoxymethyl)phenyl]methyl]-1-methylcyclopropan-1-amine
CID 115654216
1-[2-[4-(methoxymethyl)phenyl]ethyl]cyclopropan-1-amine
CID 105457986

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one?
The IUPAC name of 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one (CID 59317131) is 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one.
What is the SMILES notation for 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one?
The canonical SMILES for 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one is COCc1ccc(C2NC3(CCCC3)NC2=O)cc1.
What is the InChIKey of 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one?
The InChIKey is UROQJYCFOZYMNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-19-10-11-4-6-12(7-5-11)13-14(18)17-15(16-13)8-2-3-9-15/h4-7,13,16H,2-3,8-10H2,1H3,(H,17,18).
What are the key properties of 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one?
2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one has a molecular weight of 260.34 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one is sourced from PubChem (CID 59317131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).