1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one

C19H19FN4O2 — CID 58207232

IUPAC1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one
SMILESO=C(Cc1ccc(F)cc1)Cc1cc(N2CCOCC2)n2nccc2n1
InChIInChI=1S/C19H19FN4O2/c20-15-3-1-14(2-4-15)11-17(25)12-16-13-19(23-7-9-26-10-8-23)24-18(22-16)5-6-21-24/h1-6,13H,7-12H2
InChIKeyKPEBERZAPDNOAA-UHFFFAOYSA-N
MW354.39 g/mol
LogP2.06
Rot. Bonds5

About 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one

1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one (PubChem CID 58207232) has the molecular formula C19H19FN4O2 and a molecular weight of 354.39 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one
PubChem CID58207232
Molecular FormulaC19H19FN4O2
Molecular Weight354.39 g/mol
Exact Mass354.15
IUPAC Name1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one
SMILESO=C(Cc1ccc(F)cc1)Cc1cc(N2CCOCC2)n2nccc2n1
InChIInChI=1S/C19H19FN4O2/c20-15-3-1-14(2-4-15)11-17(25)12-16-13-19(23-7-9-26-10-8-23)24-18(22-16)5-6-21-24/h1-6,13H,7-12H2
InChIKeyKPEBERZAPDNOAA-UHFFFAOYSA-N
XLogP2.06
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.39
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyethyl)-N,2-dimethyl-3-phenyl-2-[3-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-7-yl]propanamide
CID 66964555
4-(5,6-Dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 4912264
5-(4-Fluorophenyl)-6-(2-morpholinoethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 1487690
4-(2-Methyl-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 1850847
4-(5-Isopropyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 4870355
4-(2,5-Dimethyl-3-(p-tolyl)pyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 4904826
4-(5-Methyl-3-phenyl-6-prop-2-enylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 4906222
4-(5-Methyl-3-(p-tolyl)pyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 4909114
5-methyl-N-(3-morpholin-4-ylpropyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 665812
7-(difluoromethyl)-N-morpholin-4-yl-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 995380
3-(4-Morpholinylcarbonyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 1004815
Reversan
CID 2298706

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one?
The IUPAC name of 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one (CID 58207232) is 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one.
What is the SMILES notation for 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one?
The canonical SMILES for 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one is O=C(Cc1ccc(F)cc1)Cc1cc(N2CCOCC2)n2nccc2n1.
What is the InChIKey of 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one?
The InChIKey is KPEBERZAPDNOAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O2/c20-15-3-1-14(2-4-15)11-17(25)12-16-13-19(23-7-9-26-10-8-23)24-18(22-16)5-6-21-24/h1-6,13H,7-12H2.
What are the key properties of 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one?
1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one has a molecular weight of 354.39 g/mol, XLogP of 2.06, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)propan-2-one is sourced from PubChem (CID 58207232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).