N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide

C15H15BrN2O — CID 60655374

IUPACN-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(Br)cn2)cc1C
InChIInChI=1S/C15H15BrN2O/c1-10-3-4-12(7-11(10)2)8-15(19)18-14-6-5-13(16)9-17-14/h3-7,9H,8H2,1-2H3,(H,17,18,19)
InChIKeyXGGWZNUKVJIZAT-UHFFFAOYSA-N
MW319.20 g/mol
LogP3.64
Rot. Bonds3

About N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide

N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide (PubChem CID 60655374) has the molecular formula C15H15BrN2O and a molecular weight of 319.20 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide
PubChem CID60655374
Molecular FormulaC15H15BrN2O
Molecular Weight319.20 g/mol
Exact Mass318.04
IUPAC NameN-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(Br)cn2)cc1C
InChIInChI=1S/C15H15BrN2O/c1-10-3-4-12(7-11(10)2)8-15(19)18-14-6-5-13(16)9-17-14/h3-7,9H,8H2,1-2H3,(H,17,18,19)
InChIKeyXGGWZNUKVJIZAT-UHFFFAOYSA-N
XLogP3.64
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.20
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide 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

2-(4-bromophenyl)-N-(5-bromo-2-pyridinyl)acetamide
CID 29260244
N-(2-amino-4-bromophenyl)-2-(3,4-dimethylphenyl)acetamide
CID 62552957
N-[(4-bromophenyl)methyl]-2-(3,4-dimethylphenyl)acetamide
CID 62537978
2-(4-bromophenyl)-N-(3,4-dimethylphenyl)acetamide
CID 2268328
N,2-bis(3,4-dimethylphenyl)acetamide
CID 2600237
N-(5-bromo-2-pyridinyl)-2-methylpropanamide
CID 14988412
N-(5-bromo-2-pyridinyl)-1-[2-(3,4-dimethylanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 55816440
N-(5-bromo-2-pyridinyl)-2-(5-methyl-1-benzofuran-3-yl)acetamide
CID 156620523
2-(3,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 2664751
N-(5-bromo-2-pyridinyl)-2-ethoxyacetamide
CID 60655115
1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethanone
CID 114019091
N-(5-bromo-2-pyridinyl)-3,5-dimethylbenzamide
CID 953685

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide (CID 60655374) is N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide is Cc1ccc(CC(=O)Nc2ccc(Br)cn2)cc1C.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide?
The InChIKey is XGGWZNUKVJIZAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O/c1-10-3-4-12(7-11(10)2)8-15(19)18-14-6-5-13(16)9-17-14/h3-7,9H,8H2,1-2H3,(H,17,18,19).
What are the key properties of N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide?
N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide has a molecular weight of 319.20 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-2-(3,4-dimethylphenyl)acetamide is sourced from PubChem (CID 60655374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).