methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate

C11H20N2O2 — CID 83848945

IUPACmethyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate
SMILESCOC(=O)N1CCC2(CCNC2)C1(C)C
InChIInChI=1S/C11H20N2O2/c1-10(2)11(4-6-12-8-11)5-7-13(10)9(14)15-3/h12H,4-8H2,1-3H3
InChIKeyOXOYEJLTHNUJFV-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.22
Rot. Bonds

About methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate

methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate (PubChem CID 83848945) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate.

Molecular Properties

Compound Namemethyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate
PubChem CID83848945
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Namemethyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate
SMILESCOC(=O)N1CCC2(CCNC2)C1(C)C
InChIInChI=1S/C11H20N2O2/c1-10(2)11(4-6-12-8-11)5-7-13(10)9(14)15-3/h12H,4-8H2,1-3H3
InChIKeyOXOYEJLTHNUJFV-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

methyl 1,6-diazaspiro[3.3]heptane-1-carboxylate
CID 169312195
methyl 2,2-dimethylazetidine-1-carboxylate
CID 126990009
methyl 2-tert-butyl-2-methylpiperazine-1-carboxylate
CID 175400977
methyl (3S)-3-methylpyrrolidine-3-carboxylate
CID 95020716
methyl (1S,6R)-1,6-dimethyl-7-azabicyclo[4.2.0]octane-7-carboxylate
CID 94036888
methyl 6-methyl-1,6-diazaspiro[3.3]heptane-1-carboxylate
CID 118974431
methyl (3S)-3-methylpiperidine-3-carboxylate
CID 52644166
methyl 2,8-diazaspiro[3.5]nonane-2-carboxylate
CID 83906845
methyl 4,5,5-tributyl-3,9-diazaspiro[5.5]undecane-3-carboxylate
CID 150170409
(2S)-1-methoxycarbonyl-2-methylpyrrolidine-2-carboxylic acid
CID 67496277
2,2-dimethyl-1-(3-methylpyrrolidin-3-yl)propan-1-one
CID 116570035
(4S)-N-methyl-1,8-diazaspiro[3.5]nonane-1-carboxamide
CID 97399273

Frequently Asked Questions

What is the IUPAC name of methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate?
The IUPAC name of methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate (CID 83848945) is methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate.
What is the SMILES notation for methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate?
The canonical SMILES for methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate is COC(=O)N1CCC2(CCNC2)C1(C)C.
What is the InChIKey of methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate?
The InChIKey is OXOYEJLTHNUJFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-10(2)11(4-6-12-8-11)5-7-13(10)9(14)15-3/h12H,4-8H2,1-3H3.
What are the key properties of methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate?
methyl 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-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 1,1-dimethyl-2,7-diazaspiro[4.4]nonane-2-carboxylate is sourced from PubChem (CID 83848945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).