7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one

C32H20F6N10O2 — CID 157391647

IUPAC7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one
SMILESO=c1c2cn[nH]c2c2ncc(-c3ccccn3)cc2n1CC(F)(F)F.O=c1c2cn[nH]c2c2ncc(-c3ccncc3)cc2n1CC(F)(F)F
InChIInChI=1S/2C16H10F3N5O/c17-16(18,19)8-24-12-5-10(9-1-3-20-4-2-9)6-21-14(12)13-11(15(24)25)7-22-23-13;17-16(18,19)8-24-12-5-9(11-3-1-2-4-20-11)6-21-14(12)13-10(15(24)25)7-22-23-13/h2*1-7H,8H2,(H,22,23)
InChIKeyBMBPOYIZLOUKMG-UHFFFAOYSA-N
MW690.57 g/mol
LogP5.79
Rot. Bonds4

About 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one

7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one (PubChem CID 157391647) has the molecular formula C32H20F6N10O2 and a molecular weight of 690.57 g/mol. Its IUPAC name is 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one.

Molecular Properties

Compound Name7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one
PubChem CID157391647
Molecular FormulaC32H20F6N10O2
Molecular Weight690.57 g/mol
Exact Mass690.17
IUPAC Name7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one
SMILESO=c1c2cn[nH]c2c2ncc(-c3ccccn3)cc2n1CC(F)(F)F.O=c1c2cn[nH]c2c2ncc(-c3ccncc3)cc2n1CC(F)(F)F
InChIInChI=1S/2C16H10F3N5O/c17-16(18,19)8-24-12-5-10(9-1-3-20-4-2-9)6-21-14(12)13-11(15(24)25)7-22-23-13;17-16(18,19)8-24-12-5-9(11-3-1-2-4-20-11)6-21-14(12)13-10(15(24)25)7-22-23-13/h2*1-7H,8H2,(H,22,23)
InChIKeyBMBPOYIZLOUKMG-UHFFFAOYSA-N
XLogP5.79
TPSA152.92 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500690.57
LogP ≤ 55.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one with MolForge

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Related Compounds

1-(4-benzoylpiperazin-1-yl)-2-[4-fluoro-7-(1H-pyrazol-3-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]ethane-1,2-dione
CID 5280160
N-[2-methyl-5-[[2-(4-methylpiperazin-1-yl)phenyl]methylcarbamoyl]-3-pyridinyl]-6-(2-methylpyrazol-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 71283495
US11597728, Example 262
CID 146890594
US11597728, Example 440
CID 160873598
US11597728, Example 261
CID 168058616
7-(2-methylphenyl)-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one
CID 122180349
N-[2-[4-oxo-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-7-yl]phenyl]methanesulfonamide
CID 122180353
7-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one
CID 122180354
7-(2-chloropyridin-3-yl)-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-4-one
CID 86298832
7-pyridin-3-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-4-one
CID 86298900
7-[2-(4-methylpiperazin-1-yl)pyridin-4-yl]-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-4-one
CID 86299853
7-[5-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one
CID 122180347

Frequently Asked Questions

What is the IUPAC name of 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one?
The IUPAC name of 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one (CID 157391647) is 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one.
What is the SMILES notation for 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one?
The canonical SMILES for 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one is O=c1c2cn[nH]c2c2ncc(-c3ccccn3)cc2n1CC(F)(F)F.O=c1c2cn[nH]c2c2ncc(-c3ccncc3)cc2n1CC(F)(F)F.
What is the InChIKey of 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one?
The InChIKey is BMBPOYIZLOUKMG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H10F3N5O/c17-16(18,19)8-24-12-5-10(9-1-3-20-4-2-9)6-21-14(12)13-11(15(24)25)7-22-23-13;17-16(18,19)8-24-12-5-9(11-3-1-2-4-20-11)6-21-14(12)13-10(15(24)25)7-22-23-13/h2*1-7H,8H2,(H,22,23).
What are the key properties of 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one?
7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one has a molecular weight of 690.57 g/mol, XLogP of 5.79, 4 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 7-pyridin-2-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one;7-pyridin-4-yl-5-(2,2,2-trifluoroethyl)-1H-pyrazolo[4,5-c][1,5]naphthyridin-4-one is sourced from PubChem (CID 157391647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).