[3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol

C15H24N2O2 — CID 66057982

IUPAC[3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol
SMILESOCC1(Cc2ccn(C3CCCC3)n2)CCCOC1
InChIInChI=1S/C15H24N2O2/c18-11-15(7-3-9-19-12-15)10-13-6-8-17(16-13)14-4-1-2-5-14/h6,8,14,18H,1-5,7,9-12H2
InChIKeyIFDOGDASZIBGEM-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.33
Rot. Bonds4

About [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol

[3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol (PubChem CID 66057982) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol.

Molecular Properties

Compound Name[3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol
PubChem CID66057982
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name[3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol
SMILESOCC1(Cc2ccn(C3CCCC3)n2)CCCOC1
InChIInChI=1S/C15H24N2O2/c18-11-15(7-3-9-19-12-15)10-13-6-8-17(16-13)14-4-1-2-5-14/h6,8,14,18H,1-5,7,9-12H2
InChIKeyIFDOGDASZIBGEM-UHFFFAOYSA-N
XLogP2.33
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[(1-cyclohexylpyrazol-3-yl)methyl]cyclopropyl]methanol
CID 66024341
3-[[3-(bromomethyl)oxolan-3-yl]methyl]-1-cyclohexylpyrazole
CID 66050961
N-[[3-[(1-cyclohexylpyrazol-3-yl)methyl]oxolan-3-yl]methyl]ethanamine
CID 64778892
[3-[(1-propan-2-ylpyrazol-3-yl)methyl]oxan-3-yl]methanol
CID 66060084
3-[[1-(chloromethyl)cyclobutyl]methyl]-1-cyclohexylpyrazole
CID 66035324
3-[[1-(bromomethyl)cyclopropyl]methyl]-1-cyclopentylpyrazole
CID 66049323
1-[(1-cyclohexylpyrazol-3-yl)methyl]cyclopropane-1-carboxylic acid
CID 66026844
1-[1-[(1-cyclohexylpyrazol-3-yl)methyl]cyclohexyl]-N-methylmethanamine
CID 64779878
N-[[1-[(1-cyclopentylpyrazol-3-yl)methyl]cyclopropyl]methyl]ethanamine
CID 66026217
1-[1-[(1-cyclohexylpyrazol-3-yl)methyl]cyclopropyl]ethanone
CID 106797108
1-[(1-cyclopentylpyrazol-3-yl)methyl]-2,2-dimethylcyclopentan-1-ol
CID 79863268
1-[(1-cyclopentylpyrazol-3-yl)methyl]-2,2-dimethylcyclohexan-1-ol
CID 79852504

Frequently Asked Questions

What is the IUPAC name of [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol?
The IUPAC name of [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol (CID 66057982) is [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol.
What is the SMILES notation for [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol?
The canonical SMILES for [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol is OCC1(Cc2ccn(C3CCCC3)n2)CCCOC1.
What is the InChIKey of [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol?
The InChIKey is IFDOGDASZIBGEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c18-11-15(7-3-9-19-12-15)10-13-6-8-17(16-13)14-4-1-2-5-14/h6,8,14,18H,1-5,7,9-12H2.
What are the key properties of [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol?
[3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol has a molecular weight of 264.37 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(1-cyclopentylpyrazol-3-yl)methyl]oxan-3-yl]methanol is sourced from PubChem (CID 66057982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).