2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine

C18H20FN5O — CID 95871704

IUPAC2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine
SMILESNCC[C@@H]1CN(c2cc(-c3ccccc3F)nc3ccnn23)CCO1
InChIInChI=1S/C18H20FN5O/c19-15-4-2-1-3-14(15)16-11-18(24-17(22-16)6-8-21-24)23-9-10-25-13(12-23)5-7-20/h1-4,6,8,11,13H,5,7,9-10,12,20H2/t13-/m1/s1
InChIKeyBPJXWUCCIRIWET-CYBMUJFWSA-N
MW341.39 g/mol
LogP2.09
Rot. Bonds4

About 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine

2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine (PubChem CID 95871704) has the molecular formula C18H20FN5O and a molecular weight of 341.39 g/mol. Its IUPAC name is 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine
PubChem CID95871704
Molecular FormulaC18H20FN5O
Molecular Weight341.39 g/mol
Exact Mass341.17
IUPAC Name2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine
SMILESNCC[C@@H]1CN(c2cc(-c3ccccc3F)nc3ccnn23)CCO1
InChIInChI=1S/C18H20FN5O/c19-15-4-2-1-3-14(15)16-11-18(24-17(22-16)6-8-21-24)23-9-10-25-13(12-23)5-7-20/h1-4,6,8,11,13H,5,7,9-10,12,20H2/t13-/m1/s1
InChIKeyBPJXWUCCIRIWET-CYBMUJFWSA-N
XLogP2.09
TPSA68.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-3-amine;hydrochloride
CID 154893497
5-(2-fluorophenyl)-N-(oxan-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 56909518
1-[(3S)-3-[[[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]piperidin-1-yl]ethanone
CID 95727075
N-[[(2R)-1,4-dimethylpiperazin-2-yl]methyl]-5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 95895615
2-[4-(3-chloro-4-fluorophenyl)morpholin-2-yl]ethanamine
CID 82300838
N-[(1,1-dioxothiolan-3-yl)methyl]-5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 56890807
2-[1-(5-propylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-3-yl]ethanamine
CID 56917535
5-phenyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 154842512
1-(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-3-ol
CID 170782938
5-(2-fluorophenyl)-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 56889061
7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine
CID 95861445
2-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-4-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 56883063

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine?
The IUPAC name of 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine (CID 95871704) is 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine.
What is the SMILES notation for 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine?
The canonical SMILES for 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine is NCC[C@@H]1CN(c2cc(-c3ccccc3F)nc3ccnn23)CCO1.
What is the InChIKey of 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine?
The InChIKey is BPJXWUCCIRIWET-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H20FN5O/c19-15-4-2-1-3-14(15)16-11-18(24-17(22-16)6-8-21-24)23-9-10-25-13(12-23)5-7-20/h1-4,6,8,11,13H,5,7,9-10,12,20H2/t13-/m1/s1.
What are the key properties of 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine?
2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine has a molecular weight of 341.39 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-4-[5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-2-yl]ethanamine is sourced from PubChem (CID 95871704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).