8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol

C15H24N2O — CID 114819639

IUPAC8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol
SMILESCCn1nccc1C1(O)CCC2(CCCC2)CC1
InChIInChI=1S/C15H24N2O/c1-2-17-13(5-12-16-17)15(18)10-8-14(9-11-15)6-3-4-7-14/h5,12,18H,2-4,6-11H2,1H3
InChIKeyHPEWQLWMSFZUNW-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.22
Rot. Bonds2

About 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol

8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol (PubChem CID 114819639) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol.

Molecular Properties

Compound Name8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol
PubChem CID114819639
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol
SMILESCCn1nccc1C1(O)CCC2(CCCC2)CC1
InChIInChI=1S/C15H24N2O/c1-2-17-13(5-12-16-17)15(18)10-8-14(9-11-15)6-3-4-7-14/h5,12,18H,2-4,6-11H2,1H3
InChIKeyHPEWQLWMSFZUNW-UHFFFAOYSA-N
XLogP3.22
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol?
The IUPAC name of 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol (CID 114819639) is 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol.
What is the SMILES notation for 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol?
The canonical SMILES for 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol is CCn1nccc1C1(O)CCC2(CCCC2)CC1.
What is the InChIKey of 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol?
The InChIKey is HPEWQLWMSFZUNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-17-13(5-12-16-17)15(18)10-8-14(9-11-15)6-3-4-7-14/h5,12,18H,2-4,6-11H2,1H3.
What are the key properties of 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol?
8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol has a molecular weight of 248.37 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-ethylpyrazol-3-yl)spiro[4.5]decan-8-ol is sourced from PubChem (CID 114819639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).