3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine

C20H23ClN4O — CID 45111573

IUPAC3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine
SMILESCOCCN1CCC(n2nc(-c3ccc(Cl)cc3)c3cnccc32)CC1
InChIInChI=1S/C20H23ClN4O/c1-26-13-12-24-10-7-17(8-11-24)25-19-6-9-22-14-18(19)20(23-25)15-2-4-16(21)5-3-15/h2-6,9,14,17H,7-8,10-13H2,1H3
InChIKeyKXOGGAVFFAFNKX-UHFFFAOYSA-N
MW370.88 g/mol
LogP4.03
Rot. Bonds5

About 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine

3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine (PubChem CID 45111573) has the molecular formula C20H23ClN4O and a molecular weight of 370.88 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine
PubChem CID45111573
Molecular FormulaC20H23ClN4O
Molecular Weight370.88 g/mol
Exact Mass370.16
IUPAC Name3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine
SMILESCOCCN1CCC(n2nc(-c3ccc(Cl)cc3)c3cnccc32)CC1
InChIInChI=1S/C20H23ClN4O/c1-26-13-12-24-10-7-17(8-11-24)25-19-6-9-22-14-18(19)20(23-25)15-2-4-16(21)5-3-15/h2-6,9,14,17H,7-8,10-13H2,1H3
InChIKeyKXOGGAVFFAFNKX-UHFFFAOYSA-N
XLogP4.03
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.88
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine?
The IUPAC name of 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine (CID 45111573) is 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine is COCCN1CCC(n2nc(-c3ccc(Cl)cc3)c3cnccc32)CC1.
What is the InChIKey of 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine?
The InChIKey is KXOGGAVFFAFNKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN4O/c1-26-13-12-24-10-7-17(8-11-24)25-19-6-9-22-14-18(19)20(23-25)15-2-4-16(21)5-3-15/h2-6,9,14,17H,7-8,10-13H2,1H3.
What are the key properties of 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine?
3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine has a molecular weight of 370.88 g/mol, XLogP of 4.03, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-1-[1-(2-methoxyethyl)piperidin-4-yl]pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 45111573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).