methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate

C11H20N2O2 — CID 83848926

IUPACmethyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate
SMILESCOC(=O)N1CC2(CCNCC2)CC1C
InChIInChI=1S/C11H20N2O2/c1-9-7-11(3-5-12-6-4-11)8-13(9)10(14)15-2/h9,12H,3-8H2,1-2H3
InChIKeyFDRFDDHNCGTSRZ-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.22
Rot. Bonds

About methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate

methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate (PubChem CID 83848926) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate.

Molecular Properties

Compound Namemethyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate
PubChem CID83848926
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Namemethyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate
SMILESCOC(=O)N1CC2(CCNCC2)CC1C
InChIInChI=1S/C11H20N2O2/c1-9-7-11(3-5-12-6-4-11)8-13(9)10(14)15-2/h9,12H,3-8H2,1-2H3
InChIKeyFDRFDDHNCGTSRZ-UHFFFAOYSA-N
XLogP1.22
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,5,3-dithiazepan-3-yl)-1-(3-methyl-2,8-diazaspiro[4.5]decan-2-yl)propan-1-one
CID 167824540
3-(1,5-dimethylpyrazol-4-yl)-1-(3-methyl-2,8-diazaspiro[4.5]decan-2-yl)propan-1-one
CID 138002858
(3-methyl-2,8-diazaspiro[4.5]decan-2-yl)-(1-methylindol-2-yl)methanone
CID 138004361
dimethyl (2S,5S)-2,5-dimethylpiperazine-1,4-dicarboxylate
CID 756933
4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(3-methyl-2,8-diazaspiro[4.5]decan-2-yl)butan-1-one
CID 167935045
2-(2-cyclopropylethylsulfonyl)-3-methyl-2,8-diazaspiro[4.5]decane
CID 128886066
[6-[ethyl(propyl)amino]-3-pyridinyl]-(3-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone
CID 138000280
(3S)-3-(methoxymethyl)-2-methylsulfonyl-2,8-diazaspiro[4.5]decane
CID 97475664
ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate
CID 130016002
(3R)-2-phenylmethoxycarbonyl-2,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 155904367
tert-butyl 2,7-diazaspiro[3.5]nonane-2-carboxylate;ethane
CID 168901437
2-[3-(methoxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide
CID 133140526

Frequently Asked Questions

What is the IUPAC name of methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate?
The IUPAC name of methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate (CID 83848926) is methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate.
What is the SMILES notation for methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate?
The canonical SMILES for methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate is COC(=O)N1CC2(CCNCC2)CC1C.
What is the InChIKey of methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate?
The InChIKey is FDRFDDHNCGTSRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-9-7-11(3-5-12-6-4-11)8-13(9)10(14)15-2/h9,12H,3-8H2,1-2H3.
What are the key properties of methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate?
methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate has a molecular weight of 212.29 g/mol, XLogP of 1.22, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-methyl-2,8-diazaspiro[4.5]decane-2-carboxylate is sourced from PubChem (CID 83848926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).