2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide

C17H17ClN4O2 — CID 95744862

IUPAC2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide
SMILESCOc1ccc2cc(NC(=O)Cn3nc(C)c(Cl)c3C)cnc2c1
InChIInChI=1S/C17H17ClN4O2/c1-10-17(18)11(2)22(21-10)9-16(23)20-13-6-12-4-5-14(24-3)7-15(12)19-8-13/h4-8H,9H2,1-3H3,(H,20,23)
InChIKeyDUZBPZUGKBTMBA-UHFFFAOYSA-N
MW344.80 g/mol
LogP3.35
Rot. Bonds4

About 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide

2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide (PubChem CID 95744862) has the molecular formula C17H17ClN4O2 and a molecular weight of 344.80 g/mol. Its IUPAC name is 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide
PubChem CID95744862
Molecular FormulaC17H17ClN4O2
Molecular Weight344.80 g/mol
Exact Mass344.10
IUPAC Name2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide
SMILESCOc1ccc2cc(NC(=O)Cn3nc(C)c(Cl)c3C)cnc2c1
InChIInChI=1S/C17H17ClN4O2/c1-10-17(18)11(2)22(21-10)9-16(23)20-13-6-12-4-5-14(24-3)7-15(12)19-8-13/h4-8H,9H2,1-3H3,(H,20,23)
InChIKeyDUZBPZUGKBTMBA-UHFFFAOYSA-N
XLogP3.35
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.80
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide 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

2-(4-chloro-3,5-dimethylpyrazol-1-yl)-1-(4-methoxyphenyl)ethanone
CID 62129687
3-(1,5-dimethylpyrazol-4-yl)-N-(7-methoxyquinolin-3-yl)propanamide
CID 75358407
N-(7-methoxyquinolin-3-yl)-2-(3-methylphenoxy)acetamide
CID 95744870
N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-3-carboxamide
CID 95744911
2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 15943425
2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(7-methoxyquinolin-3-yl)propanamide
CID 110279376
methyl 3-chloro-6-[[2-(4-chloro-3,5-dimethylpyrazol-1-yl)acetyl]amino]-1-benzothiophene-2-carboxylate
CID 19525326
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(4-nitrophenyl)acetamide
CID 19525102
3-[1-[(4-methoxyphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]-N-(7-methoxyquinolin-3-yl)propanamide
CID 75357077
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]acetamide
CID 19525221
N-(7-methoxyquinolin-3-yl)-2,5-dimethylbenzamide
CID 95745195
3-cyclopropyl-N-(7-methoxyquinolin-3-yl)-1-methylpyrazole-5-carboxamide
CID 95745014

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide?
The IUPAC name of 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide (CID 95744862) is 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide.
What is the SMILES notation for 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide?
The canonical SMILES for 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide is COc1ccc2cc(NC(=O)Cn3nc(C)c(Cl)c3C)cnc2c1.
What is the InChIKey of 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide?
The InChIKey is DUZBPZUGKBTMBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN4O2/c1-10-17(18)11(2)22(21-10)9-16(23)20-13-6-12-4-5-14(24-3)7-15(12)19-8-13/h4-8H,9H2,1-3H3,(H,20,23).
What are the key properties of 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide?
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide has a molecular weight of 344.80 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(7-methoxyquinolin-3-yl)acetamide is sourced from PubChem (CID 95744862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).