4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane

C12H21N — CID 168902465

IUPAC4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane
SMILESCC1CCN(C2CCC2)C2(CC2)C1
InChIInChI=1S/C12H21N/c1-10-5-8-13(11-3-2-4-11)12(9-10)6-7-12/h10-11H,2-9H2,1H3
InChIKeyONHSXXYZDXDNHP-UHFFFAOYSA-N
MW179.31 g/mol
LogP2.80
Rot. Bonds1

About 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane

4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane (PubChem CID 168902465) has the molecular formula C12H21N and a molecular weight of 179.31 g/mol. Its IUPAC name is 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane.

Molecular Properties

Compound Name4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane
PubChem CID168902465
Molecular FormulaC12H21N
Molecular Weight179.31 g/mol
Exact Mass179.17
IUPAC Name4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane
SMILESCC1CCN(C2CCC2)C2(CC2)C1
InChIInChI=1S/C12H21N/c1-10-5-8-13(11-3-2-4-11)12(9-10)6-7-12/h10-11H,2-9H2,1H3
InChIKeyONHSXXYZDXDNHP-UHFFFAOYSA-N
XLogP2.80
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.31
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(8S)-5-cyclopropyl-8-methyl-5-azaspiro[3.5]nonane;ethane
CID 169125922
4-iodo-7-methyl-4-azaspiro[2.5]octane
CID 145095628
8-tert-butyl-5-cyclopropyl-5-azaspiro[3.5]nonane
CID 171594502
(5R,8S)-1,8-dimethyl-1-azaspiro[4.4]nonane
CID 169125835
(8R)-5-cyclopropyl-8-ethenyl-5-azaspiro[3.5]nonane
CID 164868806
ethane;1-[(8S)-8-methyl-5-azaspiro[3.5]nonan-5-yl]ethanone
CID 169125133
4-cyclopentyl-7-(trifluoromethyl)-4-azaspiro[2.5]octan-7-ol
CID 177037678
1-[(1S)-3,3-dimethylcyclohexyl]-4-methylpiperidine
CID 70971560
5,5,7-trimethyl-2,3,6,7,8,8a-hexahydro-1H-indolizine
CID 123301947
5-cyclopropyl-2-propan-2-yl-5-azaspiro[3.5]nonane
CID 164867855
8-methyl-5-[2-(1-methylpiperidin-4-yl)ethyl]-5-azaspiro[3.5]nonane
CID 172630127
1-cyclobutyl-4,4-dimethylpiperidine
CID 70344031

Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane?
The IUPAC name of 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane (CID 168902465) is 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane.
What is the SMILES notation for 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane?
The canonical SMILES for 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane is CC1CCN(C2CCC2)C2(CC2)C1.
What is the InChIKey of 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane?
The InChIKey is ONHSXXYZDXDNHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N/c1-10-5-8-13(11-3-2-4-11)12(9-10)6-7-12/h10-11H,2-9H2,1H3.
What are the key properties of 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane?
4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane has a molecular weight of 179.31 g/mol, XLogP of 2.80, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyl-7-methyl-4-azaspiro[2.5]octane is sourced from PubChem (CID 168902465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).