4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane

C11H21NO — CID 172612239

IUPAC4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane
SMILESCC(C)C1CNC2(CCOC2)C1C
InChIInChI=1S/C11H21NO/c1-8(2)10-6-12-11(9(10)3)4-5-13-7-11/h8-10,12H,4-7H2,1-3H3
InChIKeyRQLIEPMNMZSTMA-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.66
Rot. Bonds1

About 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane

4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane (PubChem CID 172612239) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane.

Molecular Properties

Compound Name4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane
PubChem CID172612239
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane
SMILESCC(C)C1CNC2(CCOC2)C1C
InChIInChI=1S/C11H21NO/c1-8(2)10-6-12-11(9(10)3)4-5-13-7-11/h8-10,12H,4-7H2,1-3H3
InChIKeyRQLIEPMNMZSTMA-UHFFFAOYSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

11-methyl-4,9-dioxa-1-azaspiro[5.5]undecane
CID 130991851
3-methyl-1-(3-methyloxolan-3-yl)-6-propan-2-ylpiperazine-2,5-dione
CID 113482349
1,2-dimethyl-6-oxaspiro[2.5]octane
CID 58482279
(5R,7S)-7-methyl-2,6-dioxa-9-azaspiro[4.5]decane
CID 96936602
methyl 7-oxa-1-azaspiro[3.5]nonane-3-carboxylate;hydrochloride
CID 155970957
(3S)-3-propan-2-yloxolan-3-ol
CID 95379239
2-methyl-1,7-dioxaspiro[3.4]octane
CID 177019772
2-methyl-7-oxa-1-azaspiro[4.4]nonane
CID 83479109
8-methyl-2-oxaspiro[4.5]decane
CID 118029245
14-propan-2-yl-6,11-dioxa-13-azadispiro[3.2.57.24]tetradecane
CID 165487918
4-(1-methoxyethyl)-8-oxa-1-azaspiro[4.5]decan-2-one
CID 165462680
4-methyl-3-propan-2-yl-8-azaspiro[4.5]decane
CID 172612462

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane?
The IUPAC name of 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane (CID 172612239) is 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane.
What is the SMILES notation for 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane?
The canonical SMILES for 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane is CC(C)C1CNC2(CCOC2)C1C.
What is the InChIKey of 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane?
The InChIKey is RQLIEPMNMZSTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-8(2)10-6-12-11(9(10)3)4-5-13-7-11/h8-10,12H,4-7H2,1-3H3.
What are the key properties of 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane?
4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane has a molecular weight of 183.29 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane is sourced from PubChem (CID 172612239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).