4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide

C25H24N4O3 — CID 108747214

IUPAC4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide
SMILESCOc1ccc(C(=O)CCC(=O)Nc2cc(C)nn2-c2cc(C)c3ccccc3n2)cc1
InChIInChI=1S/C25H24N4O3/c1-16-14-23(26-21-7-5-4-6-20(16)21)29-24(15-17(2)28-29)27-25(31)13-12-22(30)18-8-10-19(32-3)11-9-18/h4-11,14-15H,12-13H2,1-3H3,(H,27,31)
InChIKeyRQOIWVVYCISLOM-UHFFFAOYSA-N
MW428.49 g/mol
LogP4.65
Rot. Bonds7

About 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide

4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide (PubChem CID 108747214) has the molecular formula C25H24N4O3 and a molecular weight of 428.49 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide
PubChem CID108747214
Molecular FormulaC25H24N4O3
Molecular Weight428.49 g/mol
Exact Mass428.18
IUPAC Name4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide
SMILESCOc1ccc(C(=O)CCC(=O)Nc2cc(C)nn2-c2cc(C)c3ccccc3n2)cc1
InChIInChI=1S/C25H24N4O3/c1-16-14-23(26-21-7-5-4-6-20(16)21)29-24(15-17(2)28-29)27-25(31)13-12-22(30)18-8-10-19(32-3)11-9-18/h4-11,14-15H,12-13H2,1-3H3,(H,27,31)
InChIKeyRQOIWVVYCISLOM-UHFFFAOYSA-N
XLogP4.65
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.49
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide 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

4-methoxy-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]benzenesulfonamide
CID 108783992
1,1-diethyl-3-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]urea
CID 108747189
5-methyl-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]furan-2-carboxamide
CID 108747229
methyl 4-[[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]amino]-4-oxobutanoate
CID 108747124
2,4-dichloro-N-[2-[[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]amino]-2-oxoethyl]benzamide
CID 108769282
2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]acetamide
CID 108800493
4-(4-chlorophenyl)-N-[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-4-oxobutanamide
CID 108731585
ethyl 5-[[4-(4-fluorophenyl)-4-oxobutanoyl]amino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate
CID 108747543
4-(4-chlorophenoxy)-N-[2-(8-methoxy-4-methylquinolin-2-yl)-5-methylpyrazol-3-yl]butanamide
CID 108769248
[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl] 4-methoxybenzoate
CID 7872728
4-(5-chloro-2-methoxyphenyl)-N-[5-methyl-2-(4,6,8-trimethylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide
CID 108746925
N-[2-(4,8-dimethylquinolin-2-yl)-5-methylpyrazol-3-yl]-4-(4-ethylphenoxy)butanamide
CID 108769710

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide?
The IUPAC name of 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide (CID 108747214) is 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide.
What is the SMILES notation for 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide?
The canonical SMILES for 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide is COc1ccc(C(=O)CCC(=O)Nc2cc(C)nn2-c2cc(C)c3ccccc3n2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide?
The InChIKey is RQOIWVVYCISLOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O3/c1-16-14-23(26-21-7-5-4-6-20(16)21)29-24(15-17(2)28-29)27-25(31)13-12-22(30)18-8-10-19(32-3)11-9-18/h4-11,14-15H,12-13H2,1-3H3,(H,27,31).
What are the key properties of 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide?
4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide has a molecular weight of 428.49 g/mol, XLogP of 4.65, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-N-[5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-oxobutanamide is sourced from PubChem (CID 108747214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).