1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol

C19H21N5O2 — CID 170995121

IUPAC1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol
SMILESOC1CCN(Cc2ccc(Oc3ccc(-c4ccn[nH]4)cn3)cn2)CC1
InChIInChI=1S/C19H21N5O2/c25-16-6-9-24(10-7-16)13-15-2-3-17(12-20-15)26-19-4-1-14(11-21-19)18-5-8-22-23-18/h1-5,8,11-12,16,25H,6-7,9-10,13H2,(H,22,23)
InChIKeyUZAUVYWHEDBLBM-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.62
Rot. Bonds5

About 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol

1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol (PubChem CID 170995121) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol
PubChem CID170995121
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol
SMILESOC1CCN(Cc2ccc(Oc3ccc(-c4ccn[nH]4)cn3)cn2)CC1
InChIInChI=1S/C19H21N5O2/c25-16-6-9-24(10-7-16)13-15-2-3-17(12-20-15)26-19-4-1-14(11-21-19)18-5-8-22-23-18/h1-5,8,11-12,16,25H,6-7,9-10,13H2,(H,22,23)
InChIKeyUZAUVYWHEDBLBM-UHFFFAOYSA-N
XLogP2.62
TPSA87.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-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 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol?
The IUPAC name of 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol (CID 170995121) is 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol.
What is the SMILES notation for 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol?
The canonical SMILES for 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol is OC1CCN(Cc2ccc(Oc3ccc(-c4ccn[nH]4)cn3)cn2)CC1.
What is the InChIKey of 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol?
The InChIKey is UZAUVYWHEDBLBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c25-16-6-9-24(10-7-16)13-15-2-3-17(12-20-15)26-19-4-1-14(11-21-19)18-5-8-22-23-18/h1-5,8,11-12,16,25H,6-7,9-10,13H2,(H,22,23).
What are the key properties of 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol?
1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol has a molecular weight of 351.41 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-[[5-(1H-pyrazol-5-yl)-2-pyridinyl]oxy]-2-pyridinyl]methyl]piperidin-4-ol is sourced from PubChem (CID 170995121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).