methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate

C11H19NO3 — CID 134920069

IUPACmethyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate
SMILESCOC(=O)C1(C)CCNC12CCCCO2
InChIInChI=1S/C11H19NO3/c1-10(9(13)14-2)6-7-12-11(10)5-3-4-8-15-11/h12H,3-8H2,1-2H3
InChIKeySLNKQRVRVITCEJ-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.06
Rot. Bonds1

About methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate

methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate (PubChem CID 134920069) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate.

Molecular Properties

Compound Namemethyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate
PubChem CID134920069
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Namemethyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate
SMILESCOC(=O)C1(C)CCNC12CCCCO2
InChIInChI=1S/C11H19NO3/c1-10(9(13)14-2)6-7-12-11(10)5-3-4-8-15-11/h12H,3-8H2,1-2H3
InChIKeySLNKQRVRVITCEJ-UHFFFAOYSA-N
XLogP1.06
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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methyl 2-(oxolan-2-yl)piperidine-2-carboxylate
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methyl 6-oxa-1-azaspiro[4.5]decane-4-carboxylate
CID 134920090
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methyl 2-acetyl-1,2-dimethylcyclopropane-1-carboxylate
CID 45086506
methyl 2-methylspiro[2.2]pentane-2-carboxylate
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Frequently Asked Questions

What is the IUPAC name of methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate?
The IUPAC name of methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate (CID 134920069) is methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate.
What is the SMILES notation for methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate?
The canonical SMILES for methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate is COC(=O)C1(C)CCNC12CCCCO2.
What is the InChIKey of methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate?
The InChIKey is SLNKQRVRVITCEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-10(9(13)14-2)6-7-12-11(10)5-3-4-8-15-11/h12H,3-8H2,1-2H3.
What are the key properties of methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate?
methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate has a molecular weight of 213.28 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-methyl-6-oxa-1-azaspiro[4.5]decane-4-carboxylate is sourced from PubChem (CID 134920069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).