2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide

C16H17BrN2O2 — CID 62131360

IUPAC2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide
SMILESCOc1ccc(C(Nc2ccc(Br)cc2)C(N)=O)cc1C
InChIInChI=1S/C16H17BrN2O2/c1-10-9-11(3-8-14(10)21-2)15(16(18)20)19-13-6-4-12(17)5-7-13/h3-9,15,19H,1-2H3,(H2,18,20)
InChIKeyUQIHYWZKIADFJR-UHFFFAOYSA-N
MW349.23 g/mol
LogP3.40
Rot. Bonds5

About 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide

2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide (PubChem CID 62131360) has the molecular formula C16H17BrN2O2 and a molecular weight of 349.23 g/mol. Its IUPAC name is 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide
PubChem CID62131360
Molecular FormulaC16H17BrN2O2
Molecular Weight349.23 g/mol
Exact Mass348.05
IUPAC Name2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide
SMILESCOc1ccc(C(Nc2ccc(Br)cc2)C(N)=O)cc1C
InChIInChI=1S/C16H17BrN2O2/c1-10-9-11(3-8-14(10)21-2)15(16(18)20)19-13-6-4-12(17)5-7-13/h3-9,15,19H,1-2H3,(H2,18,20)
InChIKeyUQIHYWZKIADFJR-UHFFFAOYSA-N
XLogP3.40
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.23
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)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-methoxy-3-methylphenyl)-2-(propan-2-ylamino)acetamide
CID 55039856
2-anilino-2-(3,4-dimethoxyphenyl)acetamide
CID 61005050
2-(4-bromo-3-methylphenyl)-2-(4-fluoroanilino)acetamide
CID 66480971
(2S)-2-(3-bromo-4-methoxyanilino)-2-phenylacetamide
CID 95623687
2-(2-methoxyethylamino)-2-(4-methoxy-3-methylphenyl)acetamide
CID 62542227
2-anilino-2-(3-chloro-4-methoxyphenyl)acetamide
CID 65026961
2-(5-bromo-2-methoxyphenyl)-2-(3-methylanilino)acetamide
CID 61004978
2-(4-bromoanilino)-2-(4-iodophenyl)acetamide
CID 114283012
2-(3-bromophenyl)-2-(2-methoxyanilino)acetamide
CID 60995761
2-(2-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetic acid
CID 62131190
N-(4-bromophenyl)-1-(3,4-dimethoxyphenyl)ethane-1,2-diamine
CID 65377060
(2R)-2-(4-bromophenyl)-2-[4-(2-hydroxyethyl)anilino]acetamide
CID 95621961

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide?
The IUPAC name of 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide (CID 62131360) is 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide?
The canonical SMILES for 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide is COc1ccc(C(Nc2ccc(Br)cc2)C(N)=O)cc1C.
What is the InChIKey of 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide?
The InChIKey is UQIHYWZKIADFJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17BrN2O2/c1-10-9-11(3-8-14(10)21-2)15(16(18)20)19-13-6-4-12(17)5-7-13/h3-9,15,19H,1-2H3,(H2,18,20).
What are the key properties of 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide?
2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide has a molecular weight of 349.23 g/mol, XLogP of 3.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromoanilino)-2-(4-methoxy-3-methylphenyl)acetamide is sourced from PubChem (CID 62131360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).