4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide

C18H14BrN3O2 — CID 78785378

IUPAC4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(Br)cc1)Nc1cccc2cccnc12
InChIInChI=1S/C18H14BrN3O2/c19-14-8-6-13(7-9-14)18(24)21-11-16(23)22-15-5-1-3-12-4-2-10-20-17(12)15/h1-10H,11H2,(H,21,24)(H,22,23)
InChIKeyZJTPMLDFTMSZMI-UHFFFAOYSA-N
MW384.23 g/mol
LogP3.37
Rot. Bonds4

About 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide

4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide (PubChem CID 78785378) has the molecular formula C18H14BrN3O2 and a molecular weight of 384.23 g/mol. Its IUPAC name is 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide.

Molecular Properties

Compound Name4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide
PubChem CID78785378
Molecular FormulaC18H14BrN3O2
Molecular Weight384.23 g/mol
Exact Mass383.03
IUPAC Name4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(Br)cc1)Nc1cccc2cccnc12
InChIInChI=1S/C18H14BrN3O2/c19-14-8-6-13(7-9-14)18(24)21-11-16(23)22-15-5-1-3-12-4-2-10-20-17(12)15/h1-10H,11H2,(H,21,24)(H,22,23)
InChIKeyZJTPMLDFTMSZMI-UHFFFAOYSA-N
XLogP3.37
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.23
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-difluoro-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide
CID 113000714
6-bromo-2-methyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]quinoline-4-carboxamide
CID 60622514
N-hydroxy-4-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide
CID 54674805
2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide
CID 17424107
N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide
CID 109010779
4-(acetamidomethyl)-N-quinolin-8-ylbenzamide
CID 18196066
2-fluoro-N-quinolin-8-ylacetamide
CID 175257606
N-[2-(2,3-dimethylanilino)-2-oxoethyl]quinoline-8-carboxamide
CID 24681832
2-[(3-acetylphenyl)carbamoylamino]-N-quinolin-8-ylacetamide
CID 52842232
6-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 66463068
2-(2-methoxyethylamino)-N-quinolin-8-ylacetamide
CID 79282594
4-amino-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]pentanamide;dihydrochloride
CID 120565209

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide?
The IUPAC name of 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide (CID 78785378) is 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide.
What is the SMILES notation for 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide?
The canonical SMILES for 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide is O=C(CNC(=O)c1ccc(Br)cc1)Nc1cccc2cccnc12.
What is the InChIKey of 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide?
The InChIKey is ZJTPMLDFTMSZMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14BrN3O2/c19-14-8-6-13(7-9-14)18(24)21-11-16(23)22-15-5-1-3-12-4-2-10-20-17(12)15/h1-10H,11H2,(H,21,24)(H,22,23).
What are the key properties of 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide?
4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide has a molecular weight of 384.23 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide is sourced from PubChem (CID 78785378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).