4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol

C13H25NO — CID 165473147

IUPAC4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol
SMILESCC(C)C1CCC(O)C2(CNCC2C)C1
InChIInChI=1S/C13H25NO/c1-9(2)11-4-5-12(15)13(6-11)8-14-7-10(13)3/h9-12,14-15H,4-8H2,1-3H3
InChIKeyRFLYRZHFFCKNJD-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.03
Rot. Bonds1

About 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol

4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol (PubChem CID 165473147) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol.

Molecular Properties

Compound Name4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol
PubChem CID165473147
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol
SMILESCC(C)C1CCC(O)C2(CNCC2C)C1
InChIInChI=1S/C13H25NO/c1-9(2)11-4-5-12(15)13(6-11)8-14-7-10(13)3/h9-12,14-15H,4-8H2,1-3H3
InChIKeyRFLYRZHFFCKNJD-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol?
The IUPAC name of 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol (CID 165473147) is 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol.
What is the SMILES notation for 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol?
The canonical SMILES for 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol is CC(C)C1CCC(O)C2(CNCC2C)C1.
What is the InChIKey of 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol?
The InChIKey is RFLYRZHFFCKNJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-9(2)11-4-5-12(15)13(6-11)8-14-7-10(13)3/h9-12,14-15H,4-8H2,1-3H3.
What are the key properties of 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol?
4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol has a molecular weight of 211.35 g/mol, XLogP of 2.03, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-9-propan-2-yl-2-azaspiro[4.5]decan-6-ol is sourced from PubChem (CID 165473147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).