2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane

C12H23NO — CID 156527484

IUPAC2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane
SMILESCCCC(C)C1CCC2(C1)CN(O)C2
InChIInChI=1S/C12H23NO/c1-3-4-10(2)11-5-6-12(7-11)8-13(14)9-12/h10-11,14H,3-9H2,1-2H3
InChIKeyNZCLCUDEIIREEN-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.91
Rot. Bonds3

About 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane

2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane (PubChem CID 156527484) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane.

Molecular Properties

Compound Name2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane
PubChem CID156527484
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane
SMILESCCCC(C)C1CCC2(C1)CN(O)C2
InChIInChI=1S/C12H23NO/c1-3-4-10(2)11-5-6-12(7-11)8-13(14)9-12/h10-11,14H,3-9H2,1-2H3
InChIKeyNZCLCUDEIIREEN-UHFFFAOYSA-N
XLogP2.91
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(6R)-2,6-di(propan-2-yl)-2-azaspiro[3.4]octane
CID 167272832
2-(6-propan-2-yl-2-azaspiro[3.4]octan-2-yl)acetic acid
CID 71244354
8-methyl-3-[4-(2-propan-2-yl-7-azaspiro[3.5]nonan-7-yl)butan-2-yl]-8-azaspiro[4.5]decane
CID 170137918
1,1,5-trimethyl-3-pentan-2-ylcycloheptane
CID 90776790
butane;pentan-2-ylcyclohexane
CID 143682251
ethane;pentan-2-ylcyclohexane
CID 143225886
1-[(1R,3S)-1-methyl-3-propan-2-ylcyclopentyl]butan-1-ol
CID 68539484
3-methylsulfanyl-7-[2-(6-propan-2-yl-2-azaspiro[3.4]octan-2-yl)ethyl]-7-azaspiro[3.5]nonane
CID 164868073
2-pentan-2-ylspiro[2.2]pentane
CID 91467438
6-butan-2-yl-2-hexan-3-ylspiro[3.3]heptane
CID 90697710
1,2-dimethyl-4-pentan-2-ylcyclopentane
CID 123931283
2-(4-methyl-5-propyloctan-2-yl)spiro[3.3]heptane
CID 142520619

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane?
The IUPAC name of 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane (CID 156527484) is 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane.
What is the SMILES notation for 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane?
The canonical SMILES for 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane is CCCC(C)C1CCC2(C1)CN(O)C2.
What is the InChIKey of 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane?
The InChIKey is NZCLCUDEIIREEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-3-4-10(2)11-5-6-12(7-11)8-13(14)9-12/h10-11,14H,3-9H2,1-2H3.
What are the key properties of 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane?
2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane has a molecular weight of 197.32 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-6-pentan-2-yl-2-azaspiro[3.4]octane is sourced from PubChem (CID 156527484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).