N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide

C18H20N4O2 — CID 136567356

IUPACN-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide
SMILESO=C(CC1CC(=O)Nc2ccccc21)Nc1cnn(C2CCC2)c1
InChIInChI=1S/C18H20N4O2/c23-17(20-13-10-19-22(11-13)14-4-3-5-14)8-12-9-18(24)21-16-7-2-1-6-15(12)16/h1-2,6-7,10-12,14H,3-5,8-9H2,(H,20,23)(H,21,24)
InChIKeyXJQMUWQJPLTVMS-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.06
Rot. Bonds4

About N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide

N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide (PubChem CID 136567356) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide.

Molecular Properties

Compound NameN-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide
PubChem CID136567356
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC NameN-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide
SMILESO=C(CC1CC(=O)Nc2ccccc21)Nc1cnn(C2CCC2)c1
InChIInChI=1S/C18H20N4O2/c23-17(20-13-10-19-22(11-13)14-4-3-5-14)8-12-9-18(24)21-16-7-2-1-6-15(12)16/h1-2,6-7,10-12,14H,3-5,8-9H2,(H,20,23)(H,21,24)
InChIKeyXJQMUWQJPLTVMS-UHFFFAOYSA-N
XLogP3.06
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide?
The IUPAC name of N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide (CID 136567356) is N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide.
What is the SMILES notation for N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide?
The canonical SMILES for N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide is O=C(CC1CC(=O)Nc2ccccc21)Nc1cnn(C2CCC2)c1.
What is the InChIKey of N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide?
The InChIKey is XJQMUWQJPLTVMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c23-17(20-13-10-19-22(11-13)14-4-3-5-14)8-12-9-18(24)21-16-7-2-1-6-15(12)16/h1-2,6-7,10-12,14H,3-5,8-9H2,(H,20,23)(H,21,24).
What are the key properties of N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide?
N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide has a molecular weight of 324.38 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide is sourced from PubChem (CID 136567356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).