N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide

C17H14BrN3O — CID 109010779

IUPACN-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide
SMILESO=C(CNc1cccc2cccnc12)Nc1ccccc1Br
InChIInChI=1S/C17H14BrN3O/c18-13-7-1-2-8-14(13)21-16(22)11-20-15-9-3-5-12-6-4-10-19-17(12)15/h1-10,20H,11H2,(H,21,22)
InChIKeyJZAKVVZKYZXDIE-UHFFFAOYSA-N
MW356.22 g/mol
LogP4.05
Rot. Bonds4

About N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide

N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide (PubChem CID 109010779) has the molecular formula C17H14BrN3O and a molecular weight of 356.22 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide
PubChem CID109010779
Molecular FormulaC17H14BrN3O
Molecular Weight356.22 g/mol
Exact Mass355.03
IUPAC NameN-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide
SMILESO=C(CNc1cccc2cccnc12)Nc1ccccc1Br
InChIInChI=1S/C17H14BrN3O/c18-13-7-1-2-8-14(13)21-16(22)11-20-15-9-3-5-12-6-4-10-19-17(12)15/h1-10,20H,11H2,(H,21,22)
InChIKeyJZAKVVZKYZXDIE-UHFFFAOYSA-N
XLogP4.05
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.22
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-diethylphenyl)-2-(quinolin-8-ylamino)acetamide
CID 109008069
N-(2,5-dichlorophenyl)-2-(quinolin-8-ylamino)acetamide
CID 109010978
N-(4-tert-butylphenyl)-2-(quinolin-8-ylamino)acetamide
CID 109008347
N-(2-bromophenyl)quinoline-8-carboxamide
CID 60651885
2-(2,5-dimethylanilino)-N-quinolin-8-ylacetamide
CID 109007395
2-(4-phenylmethoxyanilino)-N-quinolin-8-ylacetamide
CID 109010747
2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide
CID 17424107
4-bromo-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]benzamide
CID 78785378
N-(3-cyanophenyl)-2-(quinolin-8-ylamino)acetamide
CID 109010987
2-(2-morpholin-4-ylanilino)-N-quinolin-8-ylacetamide
CID 109010597
2-fluoro-N-quinolin-8-ylacetamide
CID 175257606
N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane
CID 161317877

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide?
The IUPAC name of N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide (CID 109010779) is N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide.
What is the SMILES notation for N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide?
The canonical SMILES for N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide is O=C(CNc1cccc2cccnc12)Nc1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide?
The InChIKey is JZAKVVZKYZXDIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BrN3O/c18-13-7-1-2-8-14(13)21-16(22)11-20-15-9-3-5-12-6-4-10-19-17(12)15/h1-10,20H,11H2,(H,21,22).
What are the key properties of N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide?
N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide has a molecular weight of 356.22 g/mol, XLogP of 4.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide is sourced from PubChem (CID 109010779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).