2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide

C21H22N4O2 — CID 134013002

IUPAC2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide
SMILESO=C(Cn1ncc(=O)c2ccccc21)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C21H22N4O2/c26-20-14-22-25(18-10-4-2-8-16(18)20)15-21(27)23-17-9-3-5-11-19(17)24-12-6-1-7-13-24/h2-5,8-11,14H,1,6-7,12-13,15H2,(H,23,27)
InChIKeyDLUOELZPDXRNHX-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.03
Rot. Bonds4

About 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide

2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide (PubChem CID 134013002) has the molecular formula C21H22N4O2 and a molecular weight of 362.43 g/mol. Its IUPAC name is 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide
PubChem CID134013002
Molecular FormulaC21H22N4O2
Molecular Weight362.43 g/mol
Exact Mass362.17
IUPAC Name2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide
SMILESO=C(Cn1ncc(=O)c2ccccc21)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C21H22N4O2/c26-20-14-22-25(18-10-4-2-8-16(18)20)15-21(27)23-17-9-3-5-11-19(17)24-12-6-1-7-13-24/h2-5,8-11,14H,1,6-7,12-13,15H2,(H,23,27)
InChIKeyDLUOELZPDXRNHX-UHFFFAOYSA-N
XLogP3.03
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(azocan-1-yl)-3-fluorophenyl]-2-(4-oxocinnolin-1-yl)acetamide
CID 75453687
N-(2-iodophenyl)-2-(4-oxocinnolin-1-yl)acetamide
CID 17466374
2-(4-oxocinnolin-1-yl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
CID 38853339
N-[2-(azepan-1-yl)phenyl]-2-(4-methyl-1-oxophthalazin-2-yl)acetamide
CID 38283424
N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide
CID 134012623
2-(4-oxocinnolin-1-yl)-N-pyridin-4-ylacetamide
CID 39953740
2-(2-oxoazepan-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 30583518
2-(2-oxo-1,3-benzoxazol-3-yl)-N-(2-piperidin-1-ylphenyl)acetamide
CID 18886697
2-pyrazol-1-yl-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 47126948
2-(4-oxocinnolin-1-yl)acetate
CID 7131157
2-(4-oxocinnolin-1-yl)acetic acid
CID 7131158
N-(4,5-dimethoxy-2-methylphenyl)-2-(4-oxocinnolin-1-yl)acetamide
CID 55413086

Frequently Asked Questions

What is the IUPAC name of 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide (CID 134013002) is 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide is O=C(Cn1ncc(=O)c2ccccc21)Nc1ccccc1N1CCCCC1.
What is the InChIKey of 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide?
The InChIKey is DLUOELZPDXRNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O2/c26-20-14-22-25(18-10-4-2-8-16(18)20)15-21(27)23-17-9-3-5-11-19(17)24-12-6-1-7-13-24/h2-5,8-11,14H,1,6-7,12-13,15H2,(H,23,27).
What are the key properties of 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide?
2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide has a molecular weight of 362.43 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxocinnolin-1-yl)-N-(2-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 134013002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).