5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine

C12H14FN5O — CID 133142691

IUPAC5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
SMILESCOCC1CN(c2ncc(F)cn2)Cc2ccnn21
InChIInChI=1S/C12H14FN5O/c1-19-8-11-7-17(6-10-2-3-16-18(10)11)12-14-4-9(13)5-15-12/h2-5,11H,6-8H2,1H3
InChIKeyCHJXIAKILBRBJR-UHFFFAOYSA-N
MW263.28 g/mol
LogP1.02
Rot. Bonds3

About 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine

5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine (PubChem CID 133142691) has the molecular formula C12H14FN5O and a molecular weight of 263.28 g/mol. Its IUPAC name is 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
PubChem CID133142691
Molecular FormulaC12H14FN5O
Molecular Weight263.28 g/mol
Exact Mass263.12
IUPAC Name5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
SMILESCOCC1CN(c2ncc(F)cn2)Cc2ccnn21
InChIInChI=1S/C12H14FN5O/c1-19-8-11-7-17(6-10-2-3-16-18(10)11)12-14-4-9(13)5-15-12/h2-5,11H,6-8H2,1H3
InChIKeyCHJXIAKILBRBJR-UHFFFAOYSA-N
XLogP1.02
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.28
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[7-(Trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]morpholine
CID 134852626
N,5-dimethyl-N-[2-(4-morpholinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 56889058
(3S)-3-methyl-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 32810016
2-{[(2R*,6S*)-2,6-dimethyl-4-morpholinyl]methyl}-5-(5-fluoro-2-pyrimidinyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 56898062
2-(1H-pyrazol-1-ylmethyl)-4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-oxazepane
CID 72882586
4-[4-[(2-Ethylpyrazol-3-yl)methyl]piperazin-1-yl]-2-methylpyrimidine
CID 86791685
5-fluoro-N-methyl-N-((1-methyl-1H-pyrazol-5-yl)methyl)pyrimidin-2-amine
CID 121020810
4-[2-(1-ethyl-1H-pyrazol-5-yl)-5-fluoropyrimidin-4-yl]morpholine
CID 121496357
N-methyl-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)pyrimidin-4-amine
CID 128094978
5-Fluoro-2,4-dimethyl-6-[4-[(2-methylpyrazol-3-yl)methyl]piperazin-1-yl]pyrimidine
CID 138013502
2-[3-(Trifluoromethyl)-1H-pyrazole-1-yl]-4-morpholino-6-methylpyrimidine
CID 11335968
4-[2-(3-Fluoropyrazol-1-yl)-6-methylpyrimidin-4-yl]morpholine
CID 57806055

Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The IUPAC name of 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine (CID 133142691) is 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The canonical SMILES for 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine is COCC1CN(c2ncc(F)cn2)Cc2ccnn21.
What is the InChIKey of 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
The InChIKey is CHJXIAKILBRBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN5O/c1-19-8-11-7-17(6-10-2-3-16-18(10)11)12-14-4-9(13)5-15-12/h2-5,11H,6-8H2,1H3.
What are the key properties of 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine?
5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine has a molecular weight of 263.28 g/mol, XLogP of 1.02, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-fluoropyrimidin-2-yl)-7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 133142691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).