3-methyl-1-oxa-9-azaspiro[4.5]decane

C9H17NO — CID 167145423

IUPAC3-methyl-1-oxa-9-azaspiro[4.5]decane
SMILESCC1COC2(CCCNC2)C1
InChIInChI=1S/C9H17NO/c1-8-5-9(11-6-8)3-2-4-10-7-9/h8,10H,2-7H2,1H3
InChIKeyNUHBCOYVYOJLLY-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds

About 3-methyl-1-oxa-9-azaspiro[4.5]decane

3-methyl-1-oxa-9-azaspiro[4.5]decane (PubChem CID 167145423) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 3-methyl-1-oxa-9-azaspiro[4.5]decane.

Molecular Properties

Compound Name3-methyl-1-oxa-9-azaspiro[4.5]decane
PubChem CID167145423
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name3-methyl-1-oxa-9-azaspiro[4.5]decane
SMILESCC1COC2(CCCNC2)C1
InChIInChI=1S/C9H17NO/c1-8-5-9(11-6-8)3-2-4-10-7-9/h8,10H,2-7H2,1H3
InChIKeyNUHBCOYVYOJLLY-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-oxa-8-azaspiro[3.5]nonane
CID 177330076
3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane
CID 144742113
3-methyl-1,5-dioxa-8-azaspiro[5.5]undecane
CID 112548499
(3R,5R)-3-(cyclopropylmethoxy)-1-oxa-9-azaspiro[4.5]decane
CID 97489671
(3S,5R)-3-(cyclopropylmethoxy)-1-oxa-9-azaspiro[4.5]decane;hydrochloride
CID 155846490
1-oxa-4,8-diazaspiro[5.5]undecane
CID 66799065
(6S)-1-oxa-8-azaspiro[5.5]undecane
CID 98010276
(3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol
CID 129389910
1-oxa-9-azaspiro[3.6]decane
CID 118209885
3-methyl-1-oxaspiro[4.5]decan-8-ol
CID 70367589
ethane;(3R)-3-methyl-1-oxaspiro[5.5]undecane
CID 176680246
8,10,10-trimethyl-1-oxa-4-azaspiro[5.5]undecane
CID 65122711

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-oxa-9-azaspiro[4.5]decane?
The IUPAC name of 3-methyl-1-oxa-9-azaspiro[4.5]decane (CID 167145423) is 3-methyl-1-oxa-9-azaspiro[4.5]decane.
What is the SMILES notation for 3-methyl-1-oxa-9-azaspiro[4.5]decane?
The canonical SMILES for 3-methyl-1-oxa-9-azaspiro[4.5]decane is CC1COC2(CCCNC2)C1.
What is the InChIKey of 3-methyl-1-oxa-9-azaspiro[4.5]decane?
The InChIKey is NUHBCOYVYOJLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8-5-9(11-6-8)3-2-4-10-7-9/h8,10H,2-7H2,1H3.
What are the key properties of 3-methyl-1-oxa-9-azaspiro[4.5]decane?
3-methyl-1-oxa-9-azaspiro[4.5]decane has a molecular weight of 155.24 g/mol, XLogP of 1.16, 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-9-azaspiro[4.5]decane is sourced from PubChem (CID 167145423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).