5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine

C19H19ClN4O — CID 175006327

IUPAC5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine
SMILESClc1ccc(Oc2ccc(-c3ccn(C4CCCNC4)n3)cc2)nc1
InChIInChI=1S/C19H19ClN4O/c20-15-5-8-19(22-12-15)25-17-6-3-14(4-7-17)18-9-11-24(23-18)16-2-1-10-21-13-16/h3-9,11-12,16,21H,1-2,10,13H2
InChIKeyUHHNBOGSCPHKKT-UHFFFAOYSA-N
MW354.84 g/mol
LogP4.32
Rot. Bonds4

About 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine

5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine (PubChem CID 175006327) has the molecular formula C19H19ClN4O and a molecular weight of 354.84 g/mol. Its IUPAC name is 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine.

Molecular Properties

Compound Name5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine
PubChem CID175006327
Molecular FormulaC19H19ClN4O
Molecular Weight354.84 g/mol
Exact Mass354.12
IUPAC Name5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine
SMILESClc1ccc(Oc2ccc(-c3ccn(C4CCCNC4)n3)cc2)nc1
InChIInChI=1S/C19H19ClN4O/c20-15-5-8-19(22-12-15)25-17-6-3-14(4-7-17)18-9-11-24(23-18)16-2-1-10-21-13-16/h3-9,11-12,16,21H,1-2,10,13H2
InChIKeyUHHNBOGSCPHKKT-UHFFFAOYSA-N
XLogP4.32
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.84
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine?
The IUPAC name of 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine (CID 175006327) is 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine.
What is the SMILES notation for 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine?
The canonical SMILES for 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine is Clc1ccc(Oc2ccc(-c3ccn(C4CCCNC4)n3)cc2)nc1.
What is the InChIKey of 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine?
The InChIKey is UHHNBOGSCPHKKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O/c20-15-5-8-19(22-12-15)25-17-6-3-14(4-7-17)18-9-11-24(23-18)16-2-1-10-21-13-16/h3-9,11-12,16,21H,1-2,10,13H2.
What are the key properties of 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine?
5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine has a molecular weight of 354.84 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[4-(1-piperidin-3-ylpyrazol-3-yl)phenoxy]pyridine is sourced from PubChem (CID 175006327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).