N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide

C20H18N4O3 — CID 134012623

IUPACN-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide
SMILESO=C(Cn1ncc(=O)c2ccccc21)Nc1ccccc1C(=O)NC1CC1
InChIInChI=1S/C20H18N4O3/c25-18-11-21-24(17-8-4-2-6-15(17)18)12-19(26)23-16-7-3-1-5-14(16)20(27)22-13-9-10-13/h1-8,11,13H,9-10,12H2,(H,22,27)(H,23,26)
InChIKeyHIEIEHFWYQVMMZ-UHFFFAOYSA-N
MW362.39 g/mol
LogP1.93
Rot. Bonds5

About N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide

N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide (PubChem CID 134012623) has the molecular formula C20H18N4O3 and a molecular weight of 362.39 g/mol. Its IUPAC name is N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide
PubChem CID134012623
Molecular FormulaC20H18N4O3
Molecular Weight362.39 g/mol
Exact Mass362.14
IUPAC NameN-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide
SMILESO=C(Cn1ncc(=O)c2ccccc21)Nc1ccccc1C(=O)NC1CC1
InChIInChI=1S/C20H18N4O3/c25-18-11-21-24(17-8-4-2-6-15(17)18)12-19(26)23-16-7-3-1-5-14(16)20(27)22-13-9-10-13/h1-8,11,13H,9-10,12H2,(H,22,27)(H,23,26)
InChIKeyHIEIEHFWYQVMMZ-UHFFFAOYSA-N
XLogP1.93
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-iodophenyl)-2-(4-oxocinnolin-1-yl)acetamide
CID 17466374
2-(4-oxocinnolin-1-yl)-N-pyridin-4-ylacetamide
CID 39953740
N-(2-methoxy-4-methylphenyl)-2-(4-oxocinnolin-1-yl)acetamide
CID 87028673
2-(butanoylamino)-N-cyclopropylbenzamide
CID 31824279
N-cyclopropyl-2-[(2-morpholin-4-ylacetyl)amino]benzamide
CID 2697520
2-(4-oxocinnolin-1-yl)acetic acid
CID 7131158
N-(4,5-dimethoxy-2-methylphenyl)-2-(4-oxocinnolin-1-yl)acetamide
CID 55413086
N-cyclopropyl-2-[[2-[2-(trifluoromethyl)benzimidazol-1-yl]acetyl]amino]benzamide
CID 26905640
2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]thiophene-3-carboxamide
CID 9475700
1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide
CID 8530807
N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide
CID 27995227
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(4-oxocinnolin-1-yl)acetamide
CID 55763290

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide?
The IUPAC name of N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide (CID 134012623) is N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide is O=C(Cn1ncc(=O)c2ccccc21)Nc1ccccc1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide?
The InChIKey is HIEIEHFWYQVMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O3/c25-18-11-21-24(17-8-4-2-6-15(17)18)12-19(26)23-16-7-3-1-5-14(16)20(27)22-13-9-10-13/h1-8,11,13H,9-10,12H2,(H,22,27)(H,23,26).
What are the key properties of N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide?
N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide has a molecular weight of 362.39 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]benzamide is sourced from PubChem (CID 134012623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).