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

C17H25N5O2 — CID 58206942

IUPAC5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one
SMILESCN(C)CCCC(=O)Cc1cc(N2CCOCC2)n2nccc2n1
InChIInChI=1S/C17H25N5O2/c1-20(2)7-3-4-15(23)12-14-13-17(21-8-10-24-11-9-21)22-16(19-14)5-6-18-22/h5-6,13H,3-4,7-12H2,1-2H3
InChIKeyVSTMWEYLORRVKI-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.02
Rot. Bonds7

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

5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one (PubChem CID 58206942) has the molecular formula C17H25N5O2 and a molecular weight of 331.42 g/mol. Its IUPAC name is 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one.

Molecular Properties

Compound Name5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one
PubChem CID58206942
Molecular FormulaC17H25N5O2
Molecular Weight331.42 g/mol
Exact Mass331.20
IUPAC Name5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one
SMILESCN(C)CCCC(=O)Cc1cc(N2CCOCC2)n2nccc2n1
InChIInChI=1S/C17H25N5O2/c1-20(2)7-3-4-15(23)12-14-13-17(21-8-10-24-11-9-21)22-16(19-14)5-6-18-22/h5-6,13H,3-4,7-12H2,1-2H3
InChIKeyVSTMWEYLORRVKI-UHFFFAOYSA-N
XLogP1.02
TPSA62.97 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-(5-Methylpyrazolo[1,5-a]pyrimidin-7-yl)propan-2-one
CID 85843909
3-(5,7-Dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-1-(4-methoxypiperidin-1-yl)propan-1-one
CID 56814687
2-[4-(5-Ethylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]ethanol
CID 70769412
1-(4-Fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one
CID 58207232
4,4,4-Trifluoro-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)butan-2-one
CID 58207349
5-Isopropyl-7-[2-(trifluoromethyl)-4-morpholinyl]pyrazolo[1,5-a]pyrimidine
CID 56881713
(2S)-4-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-2-(trifluoromethyl)morpholine
CID 95707094
(2R)-4-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)-2-(trifluoromethyl)morpholine
CID 95707095
4-(7-Aminopyrazolo[1,5-a]pyrimidin-5-yl)butan-2-one
CID 19709722
1-(7-Morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-phenylbutan-2-one
CID 58206944
1-Cyclopropyl-2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)ethanone
CID 58207026
Tert-butyl 4-[2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)acetyl]piperidine-1-carboxylate
CID 58207059

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one?
The IUPAC name of 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one (CID 58206942) is 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one.
What is the SMILES notation for 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one?
The canonical SMILES for 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one is CN(C)CCCC(=O)Cc1cc(N2CCOCC2)n2nccc2n1.
What is the InChIKey of 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one?
The InChIKey is VSTMWEYLORRVKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O2/c1-20(2)7-3-4-15(23)12-14-13-17(21-8-10-24-11-9-21)22-16(19-14)5-6-18-22/h5-6,13H,3-4,7-12H2,1-2H3.
What are the key properties of 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one?
5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one has a molecular weight of 331.42 g/mol, XLogP of 1.02, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-1-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pentan-2-one is sourced from PubChem (CID 58206942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).