(1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol

C15H19N3O — CID 43328996

IUPAC(1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol
SMILESOC(c1cnn(-c2ccccc2)c1)C1CCNCC1
InChIInChI=1S/C15H19N3O/c19-15(12-6-8-16-9-7-12)13-10-17-18(11-13)14-4-2-1-3-5-14/h1-5,10-12,15-16,19H,6-9H2
InChIKeyFXXFWCZWEKTRRO-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.91
Rot. Bonds3

About (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol

(1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol (PubChem CID 43328996) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol.

Molecular Properties

Compound Name(1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol
PubChem CID43328996
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name(1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol
SMILESOC(c1cnn(-c2ccccc2)c1)C1CCNCC1
InChIInChI=1S/C15H19N3O/c19-15(12-6-8-16-9-7-12)13-10-17-18(11-13)14-4-2-1-3-5-14/h1-5,10-12,15-16,19H,6-9H2
InChIKeyFXXFWCZWEKTRRO-UHFFFAOYSA-N
XLogP1.91
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

cyclohexyl-(1-phenylpyrazol-4-yl)methanol
CID 61088953
(1-phenylpyrazol-4-yl)methanediol
CID 70397428
2-(oxan-4-yl)-1-(1-phenylpyrazol-4-yl)ethanol
CID 65150583
4-[bromo(cyclopropyl)methyl]-1-phenylpyrazole
CID 61095952
(2,2-dimethylcyclopentyl)-(1-phenylpyrazol-4-yl)methanol
CID 107181622
4-[bromo(cyclobutyl)methyl]-1-phenylpyrazole
CID 61096953
N-methyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]pyrrolidin-3-amine
CID 81471251
(4-fluorophenyl)-[1-[(1-phenylpyrazol-4-yl)methyl]piperidin-4-yl]methanol
CID 110170343
(1-phenylpyrazol-4-yl)-(1H-pyrazol-5-yl)methanol
CID 114994793
2-(cyclopropylamino)-2-(1-phenylpyrazol-4-yl)acetic acid
CID 43754555
2-(1-phenylpyrazol-4-yl)-2-piperazin-1-ylacetonitrile
CID 43176136
2-(2-bicyclo[2.2.1]heptanyl)-1-(1-phenylpyrazol-4-yl)ethanol
CID 61089139

Frequently Asked Questions

What is the IUPAC name of (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol?
The IUPAC name of (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol (CID 43328996) is (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol.
What is the SMILES notation for (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol?
The canonical SMILES for (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol is OC(c1cnn(-c2ccccc2)c1)C1CCNCC1.
What is the InChIKey of (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol?
The InChIKey is FXXFWCZWEKTRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c19-15(12-6-8-16-9-7-12)13-10-17-18(11-13)14-4-2-1-3-5-14/h1-5,10-12,15-16,19H,6-9H2.
What are the key properties of (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol?
(1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol has a molecular weight of 257.34 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-phenylpyrazol-4-yl)-piperidin-4-ylmethanol is sourced from PubChem (CID 43328996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).