2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone

C17H17N5O2 — CID 58207077

IUPAC2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone
SMILESO=C(Cc1cc(N2CCOCC2)n2nccc2n1)c1ccccn1
InChIInChI=1S/C17H17N5O2/c23-15(14-3-1-2-5-18-14)11-13-12-17(21-7-9-24-10-8-21)22-16(20-13)4-6-19-22/h1-6,12H,7-11H2
InChIKeyOOBFJSZVNFFGIH-UHFFFAOYSA-N
MW323.36 g/mol
LogP1.39
Rot. Bonds4

About 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone

2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone (PubChem CID 58207077) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone.

Molecular Properties

Compound Name2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone
PubChem CID58207077
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC Name2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone
SMILESO=C(Cc1cc(N2CCOCC2)n2nccc2n1)c1ccccn1
InChIInChI=1S/C17H17N5O2/c23-15(14-3-1-2-5-18-14)11-13-12-17(21-7-9-24-10-8-21)22-16(20-13)4-6-19-22/h1-6,12H,7-11H2
InChIKeyOOBFJSZVNFFGIH-UHFFFAOYSA-N
XLogP1.39
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone?
The IUPAC name of 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone (CID 58207077) is 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone.
What is the SMILES notation for 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone?
The canonical SMILES for 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone is O=C(Cc1cc(N2CCOCC2)n2nccc2n1)c1ccccn1.
What is the InChIKey of 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone?
The InChIKey is OOBFJSZVNFFGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c23-15(14-3-1-2-5-18-14)11-13-12-17(21-7-9-24-10-8-21)22-16(20-13)4-6-19-22/h1-6,12H,7-11H2.
What are the key properties of 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone?
2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone has a molecular weight of 323.36 g/mol, XLogP of 1.39, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-1-pyridin-2-ylethanone is sourced from PubChem (CID 58207077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).