2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide

C22H20N4O2 — CID 25016476

IUPAC2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
SMILESCc1ccc2c(=O)c(-c3ccccc3)cn(CC(=O)Nc3ccn(C)n3)c2c1
InChIInChI=1S/C22H20N4O2/c1-15-8-9-17-19(12-15)26(14-21(27)23-20-10-11-25(2)24-20)13-18(22(17)28)16-6-4-3-5-7-16/h3-13H,14H2,1-2H3,(H,23,24,27)
InChIKeyHMSJHELQSJRRTQ-UHFFFAOYSA-N
MW372.43 g/mol
LogP3.35
Rot. Bonds4

About 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide

2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide (PubChem CID 25016476) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
PubChem CID25016476
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC Name2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
SMILESCc1ccc2c(=O)c(-c3ccccc3)cn(CC(=O)Nc3ccn(C)n3)c2c1
InChIInChI=1S/C22H20N4O2/c1-15-8-9-17-19(12-15)26(14-21(27)23-20-10-11-25(2)24-20)13-18(22(17)28)16-6-4-3-5-7-16/h3-13H,14H2,1-2H3,(H,23,24,27)
InChIKeyHMSJHELQSJRRTQ-UHFFFAOYSA-N
XLogP3.35
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(4-methylphenyl)acetamide
CID 25016735
2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 25015951
1-[2-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-2-oxoethyl]-7-methyl-3-phenylquinolin-4-one
CID 25018775
2-[7-methyl-3-(4-methylphenyl)-4-oxoquinolin-1-yl]acetonitrile
CID 59110332
2-[2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]pyrazole-3-carboxylic acid
CID 19485630
2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-methylpyrazol-3-yl)acetamide
CID 51241716
2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide
CID 19405127
2-(1-methyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)-N-(1-methylpyrazol-3-yl)acetamide
CID 18152736
4-methoxy-N-(1-methylpyrazol-3-yl)-3-phenylbenzamide
CID 49320232
N-(2-fluorophenyl)-2-[2-(4-methylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]acetamide
CID 16875760
2-[6-methyl-4-oxo-3-(pyridine-4-carbonyl)quinolin-1-yl]-N-phenylacetamide
CID 53000630
2-(4-aminopiperidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
CID 79327473

Frequently Asked Questions

What is the IUPAC name of 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide (CID 25016476) is 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide is Cc1ccc2c(=O)c(-c3ccccc3)cn(CC(=O)Nc3ccn(C)n3)c2c1.
What is the InChIKey of 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
The InChIKey is HMSJHELQSJRRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O2/c1-15-8-9-17-19(12-15)26(14-21(27)23-20-10-11-25(2)24-20)13-18(22(17)28)16-6-4-3-5-7-16/h3-13H,14H2,1-2H3,(H,23,24,27).
What are the key properties of 2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide?
2-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide has a molecular weight of 372.43 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-(7-methyl-4-oxo-3-phenylquinolin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide is sourced from PubChem (CID 25016476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).