4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide

C18H20N6O2 — CID 166603591

IUPAC4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide
SMILESNC(=O)c1cc(OCC2CCN(c3nccn4nccc34)CC2)ccn1
InChIInChI=1S/C18H20N6O2/c19-17(25)15-11-14(1-5-20-15)26-12-13-3-8-23(9-4-13)18-16-2-6-22-24(16)10-7-21-18/h1-2,5-7,10-11,13H,3-4,8-9,12H2,(H2,19,25)
InChIKeyPQXBAVCGIYVCPL-UHFFFAOYSA-N
MW352.40 g/mol
LogP1.52
Rot. Bonds5

About 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide

4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide (PubChem CID 166603591) has the molecular formula C18H20N6O2 and a molecular weight of 352.40 g/mol. Its IUPAC name is 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide
PubChem CID166603591
Molecular FormulaC18H20N6O2
Molecular Weight352.40 g/mol
Exact Mass352.16
IUPAC Name4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide
SMILESNC(=O)c1cc(OCC2CCN(c3nccn4nccc34)CC2)ccn1
InChIInChI=1S/C18H20N6O2/c19-17(25)15-11-14(1-5-20-15)26-12-13-3-8-23(9-4-13)18-16-2-6-22-24(16)10-7-21-18/h1-2,5-7,10-11,13H,3-4,8-9,12H2,(H2,19,25)
InChIKeyPQXBAVCGIYVCPL-UHFFFAOYSA-N
XLogP1.52
TPSA98.64 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide?
The IUPAC name of 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide (CID 166603591) is 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide.
What is the SMILES notation for 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide?
The canonical SMILES for 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide is NC(=O)c1cc(OCC2CCN(c3nccn4nccc34)CC2)ccn1.
What is the InChIKey of 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide?
The InChIKey is PQXBAVCGIYVCPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O2/c19-17(25)15-11-14(1-5-20-15)26-12-13-3-8-23(9-4-13)18-16-2-6-22-24(16)10-7-21-18/h1-2,5-7,10-11,13H,3-4,8-9,12H2,(H2,19,25).
What are the key properties of 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide?
4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide has a molecular weight of 352.40 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide is sourced from PubChem (CID 166603591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).