N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide

C23H24N4O2 — CID 56595035

IUPACN,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide
SMILESCCN(CC)C(=O)Cn1c2nn(-c3ccccc3)c(=O)c-2c(C)c2ccccc21
InChIInChI=1S/C23H24N4O2/c1-4-25(5-2)20(28)15-26-19-14-10-9-13-18(19)16(3)21-22(26)24-27(23(21)29)17-11-7-6-8-12-17/h6-14H,4-5,15H2,1-3H3
InChIKeyJOSLXCBAPHADMX-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.47
Rot. Bonds5

About N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide

N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide (PubChem CID 56595035) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide
PubChem CID56595035
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide
SMILESCCN(CC)C(=O)Cn1c2nn(-c3ccccc3)c(=O)c-2c(C)c2ccccc21
InChIInChI=1S/C23H24N4O2/c1-4-25(5-2)20(28)15-26-19-14-10-9-13-18(19)16(3)21-22(26)24-27(23(21)29)17-11-7-6-8-12-17/h6-14H,4-5,15H2,1-3H3
InChIKeyJOSLXCBAPHADMX-UHFFFAOYSA-N
XLogP3.47
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-chlorophenyl)-N-methyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide
CID 56589578
N-butyl-N-methyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide
CID 56595034
N,N-dibutyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide
CID 56595161
N-butyl-2-[2-(4-fluorophenyl)-4-methyl-3-oxopyrazolo[3,4-b]quinolin-9-yl]-N-methylacetamide
CID 56595162
N-(4-chlorophenyl)-2-[2-(4-fluorophenyl)-4-methyl-3-oxopyrazolo[3,4-b]quinolin-9-yl]-N-methylacetamide
CID 56595163
4-[[4-(Diethylamino)phenyl]methylene]-5-(dimethylamino)-2,4-dihydro-2-phenyl-3H-pyrazol-3-one
CID 54550339
3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-propyl-4(3H)-quinazolinone
CID 1256265
2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6-yl)-N,N-dipropylacetamide
CID 4106305
3-(1,5-Dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phenylquinazolin-4-one
CID 1366097
1-benzyl-N-[2-(2-methylanilino)-2-oxoethyl]-6-oxo-N-propylpyridazine-3-carboxamide
CID 24981671
6-(2-Methyl-2,3-dihydro-1H-indole-1-carbonyl)-2-[3-oxo-3-(4-phenylpiperazin-1-YL)propyl]-2,3-dihydropyridazin-3-one
CID 53066218
2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-(2-methylphenyl)propanamide
CID 3363731

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide?
The IUPAC name of N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide (CID 56595035) is N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide.
What is the SMILES notation for N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide?
The canonical SMILES for N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide is CCN(CC)C(=O)Cn1c2nn(-c3ccccc3)c(=O)c-2c(C)c2ccccc21.
What is the InChIKey of N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide?
The InChIKey is JOSLXCBAPHADMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-4-25(5-2)20(28)15-26-19-14-10-9-13-18(19)16(3)21-22(26)24-27(23(21)29)17-11-7-6-8-12-17/h6-14H,4-5,15H2,1-3H3.
What are the key properties of N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide?
N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide has a molecular weight of 388.47 g/mol, XLogP of 3.47, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(4-methyl-3-oxo-2-phenylpyrazolo[3,4-b]quinolin-9-yl)acetamide is sourced from PubChem (CID 56595035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).