6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane

C12H23NO — CID 145221794

IUPAC6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane
SMILESCC1CC2(C1)CN(COC(C)(C)C)C2
InChIInChI=1S/C12H23NO/c1-10-5-12(6-10)7-13(8-12)9-14-11(2,3)4/h10H,5-9H2,1-4H3
InChIKeyKJHBZIFGLULPAQ-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.49
Rot. Bonds2

About 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane

6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane (PubChem CID 145221794) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane
PubChem CID145221794
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane
SMILESCC1CC2(C1)CN(COC(C)(C)C)C2
InChIInChI=1S/C12H23NO/c1-10-5-12(6-10)7-13(8-12)9-14-11(2,3)4/h10H,5-9H2,1-4H3
InChIKeyKJHBZIFGLULPAQ-UHFFFAOYSA-N
XLogP2.49
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine
CID 164817435
(1R,5S)-3-[(2-methylpropan-2-yl)oxymethyl]-3-azabicyclo[3.1.0]hexan-6-amine
CID 166905468
2,6-dimethylspiro[3.3]heptane
CID 21304360
1-[(2-methylpropan-2-yl)oxymethyl]azetidine-3-carbaldehyde
CID 90788429
6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2-oxa-6-azaspiro[3.3]heptane
CID 176757671
2-(6-methyl-2-azaspiro[3.3]heptan-2-yl)ethanamine;2-methylbutane
CID 144515654
2-(2-methoxyethyl)-6-methyl-2-azaspiro[3.4]octane
CID 144866517
(4R)-1,2,4-trimethyl-2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
CID 147300512
4-(2-bromoethyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidine
CID 123168061
[3-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxymethoxymethyl]azetidin-3-yl]methanol
CID 176963420
2-[3-[(2-methylpropan-2-yl)oxymethyl]-3-azaspiro[5.5]undecan-9-yl]acetic acid
CID 90738914
tert-butyl 2-methyl-6-azaspiro[3.4]octane-6-carboxylate
CID 144719040

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane?
The IUPAC name of 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane (CID 145221794) is 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane.
What is the SMILES notation for 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane?
The canonical SMILES for 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane is CC1CC2(C1)CN(COC(C)(C)C)C2.
What is the InChIKey of 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane?
The InChIKey is KJHBZIFGLULPAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-10-5-12(6-10)7-13(8-12)9-14-11(2,3)4/h10H,5-9H2,1-4H3.
What are the key properties of 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane?
6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane has a molecular weight of 197.32 g/mol, XLogP of 2.49, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane is sourced from PubChem (CID 145221794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).