6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one

C21H14FN5O — CID 137438750

IUPAC6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one
SMILESCn1ccc(-c2nc3[nH]ccc(=O)c3cc2-c2cc(F)c3ncccc3c2)n1
InChIInChI=1S/C21H14FN5O/c1-27-8-5-17(26-27)20-14(11-15-18(28)4-7-24-21(15)25-20)13-9-12-3-2-6-23-19(12)16(22)10-13/h2-11H,1H3,(H,24,25,28)
InChIKeyMXMLSRLRZMZXFJ-UHFFFAOYSA-N
MW371.38 g/mol
LogP3.68
Rot. Bonds2

About 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one

6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one (PubChem CID 137438750) has the molecular formula C21H14FN5O and a molecular weight of 371.38 g/mol. Its IUPAC name is 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one
PubChem CID137438750
Molecular FormulaC21H14FN5O
Molecular Weight371.38 g/mol
Exact Mass371.12
IUPAC Name6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one
SMILESCn1ccc(-c2nc3[nH]ccc(=O)c3cc2-c2cc(F)c3ncccc3c2)n1
InChIInChI=1S/C21H14FN5O/c1-27-8-5-17(26-27)20-14(11-15-18(28)4-7-24-21(15)25-20)13-9-12-3-2-6-23-19(12)16(22)10-13/h2-11H,1H3,(H,24,25,28)
InChIKeyMXMLSRLRZMZXFJ-UHFFFAOYSA-N
XLogP3.68
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.38
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Amino-1-(4-fluorophenyl)-4-[3-(pyridin-3-yl)benzoyl]pyrazole
CID 9950664
2-fluoro-N-methyl-4-[3-[1-[3-(1-methylpyrazol-4-yl)quinolin-6-yl]ethyl]triazolo[4,5-b]pyrazin-5-yl]benzamide
CID 137644947
[8-(4-Methylpiperazin-1-yl)-2,3-dihydropyrrolo[3,2-g]isoquinolin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 44404249
6-[4-methyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3H-quinazolin-4-one
CID 136254194
N-(1-ethyl-8-methylpyrazolo[3,4-b]quinolin-3-yl)pyridine-3-carboxamide
CID 664677
1-[4-[(1-Methylpyrazolo[3,4-b]quinolin-4-yl)amino]phenyl]ethanone
CID 44446747
3-((3-(6-Methylpyridin-2-yl)-4-(quinolin-6-yl)-1H-pyrazol-1-yl)methyl)benzamide
CID 46907143
3-((4-(6-Methylpyridin-2-yl)-3-(quinolin-6-yl)-1H-pyrazol-1-yl)methyl)benzamide
CID 46907179
3-Methyl-6-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]quinazolin-4-one
CID 66561650
N-(5-fluoropyridin-2-yl)-6-(pyrimidine-5-carbonyl)quinoline-8-carboxamide
CID 118378691
6-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]-3H-quinazolin-4-one
CID 136254195
5-methyl-1-(3-methyl-2-pyridinyl)-N-quinolin-2-ylpyrazole-4-carboxamide
CID 137375516

Frequently Asked Questions

What is the IUPAC name of 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one?
The IUPAC name of 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one (CID 137438750) is 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one is Cn1ccc(-c2nc3[nH]ccc(=O)c3cc2-c2cc(F)c3ncccc3c2)n1.
What is the InChIKey of 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one?
The InChIKey is MXMLSRLRZMZXFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14FN5O/c1-27-8-5-17(26-27)20-14(11-15-18(28)4-7-24-21(15)25-20)13-9-12-3-2-6-23-19(12)16(22)10-13/h2-11H,1H3,(H,24,25,28).
What are the key properties of 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one?
6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one has a molecular weight of 371.38 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(8-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 137438750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).