3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane

C13H27NO — CID 144742113

IUPAC3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane
SMILESCC(C)C.CC1COC2(CCNCC2)C1
InChIInChI=1S/C9H17NO.C4H10/c1-8-6-9(11-7-8)2-4-10-5-3-9;1-4(2)3/h8,10H,2-7H2,1H3;4H,1-3H3
InChIKeyGCBQNJHOIOCZSR-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.83
Rot. Bonds

About 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane

3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane (PubChem CID 144742113) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane.

Molecular Properties

Compound Name3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane
PubChem CID144742113
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane
SMILESCC(C)C.CC1COC2(CCNCC2)C1
InChIInChI=1S/C9H17NO.C4H10/c1-8-6-9(11-7-8)2-4-10-5-3-9;1-4(2)3/h8,10H,2-7H2,1H3;4H,1-3H3
InChIKeyGCBQNJHOIOCZSR-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-oxa-9-azaspiro[4.5]decane
CID 167145423
3-fluoro-1-oxa-8-azaspiro[4.5]decane
CID 55280856
3-tert-butyl-1-oxa-8-azaspiro[4.5]decane
CID 171431706
3-methyl-1-oxaspiro[4.5]decan-8-ol
CID 70367589
methyl 2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanoate
CID 106941120
2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)-N-propan-2-ylpropanamide
CID 102930305
3-pent-3-ynoxy-1-oxa-8-azaspiro[4.5]decane
CID 102930141
N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
CID 102930345
(3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol
CID 129389910
1-oxa-9-azaspiro[5.5]undecan-4-ol
CID 56760832
(6S)-6-methyl-4-oxaspiro[2.5]octane
CID 153270450
(3R)-3-phenyl-1-oxa-8-azaspiro[4.5]decane
CID 124703511

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane?
The IUPAC name of 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane (CID 144742113) is 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane.
What is the SMILES notation for 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane?
The canonical SMILES for 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane is CC(C)C.CC1COC2(CCNCC2)C1.
What is the InChIKey of 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane?
The InChIKey is GCBQNJHOIOCZSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.C4H10/c1-8-6-9(11-7-8)2-4-10-5-3-9;1-4(2)3/h8,10H,2-7H2,1H3;4H,1-3H3.
What are the key properties of 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane?
3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane has a molecular weight of 213.36 g/mol, XLogP of 2.83, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane is sourced from PubChem (CID 144742113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).