1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide

C25H19N5O4 — CID 151355496

IUPAC1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide
SMILESCOc1ccc2c(Oc3ccc(-n4cc(C(N)=O)c(=O)n4-c4ccccc4)nc3)ccnc2c1
InChIInChI=1S/C25H19N5O4/c1-33-17-7-9-19-21(13-17)27-12-11-22(19)34-18-8-10-23(28-14-18)29-15-20(24(26)31)25(32)30(29)16-5-3-2-4-6-16/h2-15H,1H3,(H2,26,31)
InChIKeyONJQMAAALBEIGV-UHFFFAOYSA-N
MW453.46 g/mol
LogP3.47
Rot. Bonds6

About 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide

1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide (PubChem CID 151355496) has the molecular formula C25H19N5O4 and a molecular weight of 453.46 g/mol. Its IUPAC name is 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide.

Molecular Properties

Compound Name1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide
PubChem CID151355496
Molecular FormulaC25H19N5O4
Molecular Weight453.46 g/mol
Exact Mass453.14
IUPAC Name1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide
SMILESCOc1ccc2c(Oc3ccc(-n4cc(C(N)=O)c(=O)n4-c4ccccc4)nc3)ccnc2c1
InChIInChI=1S/C25H19N5O4/c1-33-17-7-9-19-21(13-17)27-12-11-22(19)34-18-8-10-23(28-14-18)29-15-20(24(26)31)25(32)30(29)16-5-3-2-4-6-16/h2-15H,1H3,(H2,26,31)
InChIKeyONJQMAAALBEIGV-UHFFFAOYSA-N
XLogP3.47
TPSA114.26 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.46
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-1-methyl-3-oxo-2-phenylpyrazole-4-carboxamide
CID 44516532
1-(2,2-dimethylpropyl)-N-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-5-methyl-3-oxo-2-phenylpyrazole-4-carboxamide
CID 160606209
[(2R)-1-[4-[[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]carbamoyl]-5-methyl-3-oxo-2-phenylpyrazol-1-yl]propan-2-yl] (2S)-2-aminopropanoate;hydrochloride
CID 66669934
[(2R)-1-[4-[[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]carbamoyl]-5-methyl-3-oxo-2-phenylpyrazol-1-yl]propan-2-yl] 2-aminoacetate
CID 66670758
1-(2-methoxyethyl)-2-[3-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]phenyl]-5-methyl-3-oxopyrazole-4-carboxamide
CID 142778496
1-[4-[[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]carbamoyl]-5-methyl-3-oxo-2-phenylpyrazol-1-yl]propan-2-yl 2-(methylamino)acetate
CID 68740542
benzoic acid;[(2R)-1-[4-[[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]carbamoyl]-5-methyl-3-oxo-2-phenylpyrazol-1-yl]propan-2-yl] (2S)-2-aminopropanoate
CID 46937601
1-[4-[[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]carbamoyl]-5-methyl-3-oxo-2-phenylpyrazol-1-yl]propan-2-yl 2-(methylamino)acetate;hydrochloride
CID 68742173
7-methoxy-4-pyridin-3-yloxyquinoline
CID 154308048
[(2R)-1-[4-[[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]carbamoyl]-5-methyl-3-oxo-2-phenylpyrazol-1-yl]propan-2-yl] 2-(methylamino)acetate;oxalic acid
CID 46938116
[(2R)-1-[4-[[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]carbamoyl]-5-methyl-3-oxo-2-phenylpyrazolidin-1-yl]propan-2-yl] (2S)-2-aminopropanoate
CID 70852559
(2S,3R)-2-amino-4-[4-[[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]carbamoyl]-5-methyl-3-oxo-2-phenylpyrazol-1-yl]-2,3-dimethylbutanoic acid;(Z)-but-2-enedioic acid
CID 68743606

Frequently Asked Questions

What is the IUPAC name of 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide?
The IUPAC name of 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide (CID 151355496) is 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide.
What is the SMILES notation for 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide?
The canonical SMILES for 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide is COc1ccc2c(Oc3ccc(-n4cc(C(N)=O)c(=O)n4-c4ccccc4)nc3)ccnc2c1.
What is the InChIKey of 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide?
The InChIKey is ONJQMAAALBEIGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N5O4/c1-33-17-7-9-19-21(13-17)27-12-11-22(19)34-18-8-10-23(28-14-18)29-15-20(24(26)31)25(32)30(29)16-5-3-2-4-6-16/h2-15H,1H3,(H2,26,31).
What are the key properties of 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide?
1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide has a molecular weight of 453.46 g/mol, XLogP of 3.47, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(7-methoxyquinolin-4-yl)oxy-2-pyridinyl]-3-oxo-2-phenylpyrazole-4-carboxamide is sourced from PubChem (CID 151355496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).