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

C20H23N5O2 — CID 58207353

IUPAC1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one
SMILESO=C(CCCc1ccccn1)Cc1cc(N2CCOCC2)n2nccc2n1
InChIInChI=1S/C20H23N5O2/c26-18(6-3-5-16-4-1-2-8-21-16)14-17-15-20(24-10-12-27-13-11-24)25-19(23-17)7-9-22-25/h1-2,4,7-9,15H,3,5-6,10-14H2
InChIKeyOSCWGQXQZZIHAM-UHFFFAOYSA-N
MW365.44 g/mol
LogP2.10
Rot. Bonds7

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

1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one (PubChem CID 58207353) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one.

Molecular Properties

Compound Name1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one
PubChem CID58207353
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC Name1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one
SMILESO=C(CCCc1ccccn1)Cc1cc(N2CCOCC2)n2nccc2n1
InChIInChI=1S/C20H23N5O2/c26-18(6-3-5-16-4-1-2-8-21-16)14-17-15-20(24-10-12-27-13-11-24)25-19(23-17)7-9-22-25/h1-2,4,7-9,15H,3,5-6,10-14H2
InChIKeyOSCWGQXQZZIHAM-UHFFFAOYSA-N
XLogP2.10
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one?
The IUPAC name of 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one (CID 58207353) is 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one.
What is the SMILES notation for 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one?
The canonical SMILES for 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one is O=C(CCCc1ccccn1)Cc1cc(N2CCOCC2)n2nccc2n1.
What is the InChIKey of 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one?
The InChIKey is OSCWGQXQZZIHAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c26-18(6-3-5-16-4-1-2-8-21-16)14-17-15-20(24-10-12-27-13-11-24)25-19(23-17)7-9-22-25/h1-2,4,7-9,15H,3,5-6,10-14H2.
What are the key properties of 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one?
1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one has a molecular weight of 365.44 g/mol, XLogP of 2.10, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-pyridin-2-ylpentan-2-one is sourced from PubChem (CID 58207353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).