N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide

C18H15BrN2O2 — CID 112978729

IUPACN-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide
SMILESCc1cc(NC(=O)COc2ccc3ncccc3c2)ccc1Br
InChIInChI=1S/C18H15BrN2O2/c1-12-9-14(4-6-16(12)19)21-18(22)11-23-15-5-7-17-13(10-15)3-2-8-20-17/h2-10H,11H2,1H3,(H,21,22)
InChIKeyHRRRLRHNIMAQTO-UHFFFAOYSA-N
MW371.23 g/mol
LogP4.32
Rot. Bonds4

About N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide

N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide (PubChem CID 112978729) has the molecular formula C18H15BrN2O2 and a molecular weight of 371.23 g/mol. Its IUPAC name is N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide.

Molecular Properties

Compound NameN-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide
PubChem CID112978729
Molecular FormulaC18H15BrN2O2
Molecular Weight371.23 g/mol
Exact Mass370.03
IUPAC NameN-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide
SMILESCc1cc(NC(=O)COc2ccc3ncccc3c2)ccc1Br
InChIInChI=1S/C18H15BrN2O2/c1-12-9-14(4-6-16(12)19)21-18(22)11-23-15-5-7-17-13(10-15)3-2-8-20-17/h2-10H,11H2,1H3,(H,21,22)
InChIKeyHRRRLRHNIMAQTO-UHFFFAOYSA-N
XLogP4.32
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.23
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-methylphenyl)-2-quinolin-6-yloxyacetamide
CID 112978684
N-(4-methoxyphenyl)-2-quinolin-6-yloxyacetamide
CID 112978693
N-(2-bromophenyl)-2-quinolin-6-yloxyacetamide
CID 112978725
methyl 3-[(2-quinolin-6-yloxyacetyl)amino]benzoate
CID 112978710
2-(4-bromo-3-methylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 1010190
N,N-dimethyl-3-[(2-quinolin-6-yloxyacetyl)amino]benzamide
CID 60595070
N-(1,3-benzodioxol-5-yl)-2-quinolin-6-yloxyacetamide
CID 112978730
N,N'-di(quinolin-6-yl)propanediamide
CID 2837594
N-(4-bromo-3-methylphenyl)-2-(3-methylphenoxy)acetamide;oxalic acid
CID 171154742
N-(4-bromo-3-methylphenyl)-2-(4-methylsulfonylphenoxy)acetamide
CID 51174629
N-(4-bromo-3-methylphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 7467598
methyl 2-[4-[2-(4-bromo-3-methylanilino)-2-oxoethoxy]phenyl]acetate
CID 7695168

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide?
The IUPAC name of N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide (CID 112978729) is N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide.
What is the SMILES notation for N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide?
The canonical SMILES for N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide is Cc1cc(NC(=O)COc2ccc3ncccc3c2)ccc1Br.
What is the InChIKey of N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide?
The InChIKey is HRRRLRHNIMAQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrN2O2/c1-12-9-14(4-6-16(12)19)21-18(22)11-23-15-5-7-17-13(10-15)3-2-8-20-17/h2-10H,11H2,1H3,(H,21,22).
What are the key properties of N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide?
N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide has a molecular weight of 371.23 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-methylphenyl)-2-quinolin-6-yloxyacetamide is sourced from PubChem (CID 112978729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).