5-methyl-5-azaspiro[2.4]heptan-2-ol

C7H13NO — CID 122450701

IUPAC5-methyl-5-azaspiro[2.4]heptan-2-ol
SMILESCN1CCC2(CC2O)C1
InChIInChI=1S/C7H13NO/c1-8-3-2-7(5-8)4-6(7)9/h6,9H,2-5H2,1H3
InChIKeyCRKPUPASMZFCNN-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.07
Rot. Bonds

About 5-methyl-5-azaspiro[2.4]heptan-2-ol

5-methyl-5-azaspiro[2.4]heptan-2-ol (PubChem CID 122450701) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 5-methyl-5-azaspiro[2.4]heptan-2-ol.

Molecular Properties

Compound Name5-methyl-5-azaspiro[2.4]heptan-2-ol
PubChem CID122450701
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name5-methyl-5-azaspiro[2.4]heptan-2-ol
SMILESCN1CCC2(CC2O)C1
InChIInChI=1S/C7H13NO/c1-8-3-2-7(5-8)4-6(7)9/h6,9H,2-5H2,1H3
InChIKeyCRKPUPASMZFCNN-UHFFFAOYSA-N
XLogP0.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-5-azaspiro[2.4]heptan-2-ol?
The IUPAC name of 5-methyl-5-azaspiro[2.4]heptan-2-ol (CID 122450701) is 5-methyl-5-azaspiro[2.4]heptan-2-ol.
What is the SMILES notation for 5-methyl-5-azaspiro[2.4]heptan-2-ol?
The canonical SMILES for 5-methyl-5-azaspiro[2.4]heptan-2-ol is CN1CCC2(CC2O)C1.
What is the InChIKey of 5-methyl-5-azaspiro[2.4]heptan-2-ol?
The InChIKey is CRKPUPASMZFCNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-8-3-2-7(5-8)4-6(7)9/h6,9H,2-5H2,1H3.
What are the key properties of 5-methyl-5-azaspiro[2.4]heptan-2-ol?
5-methyl-5-azaspiro[2.4]heptan-2-ol has a molecular weight of 127.19 g/mol, XLogP of 0.07, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-azaspiro[2.4]heptan-2-ol is sourced from PubChem (CID 122450701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).