piperidin-3-yl(1H-pyrazol-4-yl)methanol

C9H15N3O — CID 84658052

IUPACpiperidin-3-yl(1H-pyrazol-4-yl)methanol
SMILESOC(c1cn[nH]c1)C1CCCNC1
InChIInChI=1S/C9H15N3O/c13-9(8-5-11-12-6-8)7-2-1-3-10-4-7/h5-7,9-10,13H,1-4H2,(H,11,12)
InChIKeyAJDADFBANXSNRB-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.44
Rot. Bonds2

About piperidin-3-yl(1H-pyrazol-4-yl)methanol

piperidin-3-yl(1H-pyrazol-4-yl)methanol (PubChem CID 84658052) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is piperidin-3-yl(1H-pyrazol-4-yl)methanol.

Molecular Properties

Compound Namepiperidin-3-yl(1H-pyrazol-4-yl)methanol
PubChem CID84658052
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Namepiperidin-3-yl(1H-pyrazol-4-yl)methanol
SMILESOC(c1cn[nH]c1)C1CCCNC1
InChIInChI=1S/C9H15N3O/c13-9(8-5-11-12-6-8)7-2-1-3-10-4-7/h5-7,9-10,13H,1-4H2,(H,11,12)
InChIKeyAJDADFBANXSNRB-UHFFFAOYSA-N
XLogP0.44
TPSA60.94 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5,5,5-trifluoro-3-methyl-1-(1H-pyrazol-4-yl)pentan-1-ol
CID 165472283
5,5-difluoro-1-(1H-pyrazol-4-yl)pentan-1-ol
CID 165743299
3-ethyl-5,5-difluoro-1-(1H-pyrazol-4-yl)pentan-1-ol
CID 165945554
5,5,5-trifluoro-1-(1H-pyrazol-4-yl)pentan-1-ol
CID 165945558
5,5-difluoro-3-methyl-1-(1H-pyrazol-4-yl)pentan-1-ol
CID 165946732
4-[(1H-pyrazol-4-yl)methyl]piperidin-4-ol
CID 90447923
(1R,2S)-2-(dimethylamino)-4-methyl-1-(1H-pyrazol-4-yl)pentan-1-ol
CID 118203086
Cyclobutyl(1H-pyrazol-4-yl)methanol
CID 130573129
2-(5-(1H-Pyrazol-4-yl)piperidin-3-yl)propan-2-ol
CID 139343308
3-(1H-Pyrazol-4-yl)piperidin-3-ol
CID 139343414
3-(1H-Pyrazol-4-yl)piperidin-4-ol
CID 139343478
(5-(1H-Pyrazol-4-yl)piperidin-3-yl)methanol
CID 139343503

Frequently Asked Questions

What is the IUPAC name of piperidin-3-yl(1H-pyrazol-4-yl)methanol?
The IUPAC name of piperidin-3-yl(1H-pyrazol-4-yl)methanol (CID 84658052) is piperidin-3-yl(1H-pyrazol-4-yl)methanol.
What is the SMILES notation for piperidin-3-yl(1H-pyrazol-4-yl)methanol?
The canonical SMILES for piperidin-3-yl(1H-pyrazol-4-yl)methanol is OC(c1cn[nH]c1)C1CCCNC1.
What is the InChIKey of piperidin-3-yl(1H-pyrazol-4-yl)methanol?
The InChIKey is AJDADFBANXSNRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c13-9(8-5-11-12-6-8)7-2-1-3-10-4-7/h5-7,9-10,13H,1-4H2,(H,11,12).
What are the key properties of piperidin-3-yl(1H-pyrazol-4-yl)methanol?
piperidin-3-yl(1H-pyrazol-4-yl)methanol has a molecular weight of 181.24 g/mol, XLogP of 0.44, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-3-yl(1H-pyrazol-4-yl)methanol is sourced from PubChem (CID 84658052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).