4-methyl-1-oxa-4-azaspiro[5.5]undecane

C10H19NO — CID 23544679

IUPAC4-methyl-1-oxa-4-azaspiro[5.5]undecane
SMILESCN1CCOC2(CCCCC2)C1
InChIInChI=1S/C10H19NO/c1-11-7-8-12-10(9-11)5-3-2-4-6-10/h2-9H2,1H3
InChIKeyKTVKZZWYZQBPEO-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.65
Rot. Bonds

About 4-methyl-1-oxa-4-azaspiro[5.5]undecane

4-methyl-1-oxa-4-azaspiro[5.5]undecane (PubChem CID 23544679) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 4-methyl-1-oxa-4-azaspiro[5.5]undecane.

Molecular Properties

Compound Name4-methyl-1-oxa-4-azaspiro[5.5]undecane
PubChem CID23544679
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name4-methyl-1-oxa-4-azaspiro[5.5]undecane
SMILESCN1CCOC2(CCCCC2)C1
InChIInChI=1S/C10H19NO/c1-11-7-8-12-10(9-11)5-3-2-4-6-10/h2-9H2,1H3
InChIKeyKTVKZZWYZQBPEO-UHFFFAOYSA-N
XLogP1.65
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Oxa-4-azaspiro[5.5]undecane
CID 23356342
4-(Cyclohexylmethyl)morpholine
CID 641545
1-[[4-(2-Methoxyethyl)piperazin-1-yl]methyl]cyclohexan-1-ol
CID 53531839
1-[[4-(2-Ethoxyethyl)piperazin-1-yl]methyl]cyclohexan-1-ol
CID 53591708
1-[(Morpholin-4-yl)methyl]cyclohexan-1-ol
CID 14044368
2-Methyl-1-oxa-4-azaspiro[5.5]undecane
CID 55262469
1-[(5-Fluoro-3-methyloxan-2-yl)methyl]-3-methylpiperidine
CID 70882705
1-[(4-Fluoro-3-methyloxan-2-yl)methyl]-4-methylpiperidine
CID 70882706
1-[(5-Fluoro-3-methyloxan-2-yl)methyl]-4-methylpiperidine
CID 70882707
1-[(4-Fluoro-3-methyloxan-2-yl)methyl]-3-methylpiperidine
CID 70882708
3-Fluoro-4-methyl-1-[(3-methyloxan-2-yl)methyl]piperidine
CID 70882709
(3R,4R)-3-fluoro-4-methyl-1-[[(2S,3R)-3-methyloxan-2-yl]methyl]piperidine
CID 70882711

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-oxa-4-azaspiro[5.5]undecane?
The IUPAC name of 4-methyl-1-oxa-4-azaspiro[5.5]undecane (CID 23544679) is 4-methyl-1-oxa-4-azaspiro[5.5]undecane.
What is the SMILES notation for 4-methyl-1-oxa-4-azaspiro[5.5]undecane?
The canonical SMILES for 4-methyl-1-oxa-4-azaspiro[5.5]undecane is CN1CCOC2(CCCCC2)C1.
What is the InChIKey of 4-methyl-1-oxa-4-azaspiro[5.5]undecane?
The InChIKey is KTVKZZWYZQBPEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-11-7-8-12-10(9-11)5-3-2-4-6-10/h2-9H2,1H3.
What are the key properties of 4-methyl-1-oxa-4-azaspiro[5.5]undecane?
4-methyl-1-oxa-4-azaspiro[5.5]undecane has a molecular weight of 169.27 g/mol, XLogP of 1.65, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-oxa-4-azaspiro[5.5]undecane is sourced from PubChem (CID 23544679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).