(2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one

C14H18N2O2 — CID 97179322

IUPAC(2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one
SMILESCOc1ccc([C@H]2NC3(CCCC3)NC2=O)cc1
InChIInChI=1S/C14H18N2O2/c1-18-11-6-4-10(5-7-11)12-13(17)16-14(15-12)8-2-3-9-14/h4-7,12,15H,2-3,8-9H2,1H3,(H,16,17)/t12-/m1/s1
InChIKeyWOLUQUCYSLRSBA-GFCCVEGCSA-N
MW246.31 g/mol
LogP1.73
Rot. Bonds2

About (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one

(2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one (PubChem CID 97179322) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one.

Molecular Properties

Compound Name(2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one
PubChem CID97179322
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name(2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one
SMILESCOc1ccc([C@H]2NC3(CCCC3)NC2=O)cc1
InChIInChI=1S/C14H18N2O2/c1-18-11-6-4-10(5-7-11)12-13(17)16-14(15-12)8-2-3-9-14/h4-7,12,15H,2-3,8-9H2,1H3,(H,16,17)/t12-/m1/s1
InChIKeyWOLUQUCYSLRSBA-GFCCVEGCSA-N
XLogP1.73
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(methoxymethyl)phenyl]-1,4-diazaspiro[4.4]nonan-3-one
CID 59317131
(4S)-4-(4-methoxyphenyl)-2-azaspiro[4.4]nonan-1-one
CID 125451516
(8R)-8-(4-methoxyphenyl)-1-methyl-2,6-diazabicyclo[2.2.2]octane-3,5-dione
CID 7332817
ethane;3-(4-methoxyphenyl)-1,4-diazepan-2-one
CID 171840578
1,2-bis(4-methoxyphenyl)-2-azaspiro[3.4]octan-3-one
CID 2945930
2-(4-methoxyphenyl)-1-oxaspiro[4.5]decan-4-one
CID 71394804
1-(4,4-dimethylcyclohexyl)-4-methoxybenzene
CID 18414650
2-(4-methoxyphenyl)piperidin-3-one;hydrochloride
CID 115044476
3-[(4-methoxyphenyl)methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 130201562
2-(4-methoxyphenyl)thiomorpholin-3-one
CID 14480955
(3S)-3-(4-methoxyphenyl)pyrrolidin-2-one
CID 94827666
(8S)-8-[(4-methoxyphenyl)methyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 131931832

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one?
The IUPAC name of (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one (CID 97179322) is (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one.
What is the SMILES notation for (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one?
The canonical SMILES for (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one is COc1ccc([C@H]2NC3(CCCC3)NC2=O)cc1.
What is the InChIKey of (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one?
The InChIKey is WOLUQUCYSLRSBA-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-18-11-6-4-10(5-7-11)12-13(17)16-14(15-12)8-2-3-9-14/h4-7,12,15H,2-3,8-9H2,1H3,(H,16,17)/t12-/m1/s1.
What are the key properties of (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one?
(2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one has a molecular weight of 246.31 g/mol, XLogP of 1.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methoxyphenyl)-1,4-diazaspiro[4.4]nonan-3-one is sourced from PubChem (CID 97179322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).