2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide

C15H14BrClN2O — CID 61401955

IUPAC2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide
SMILESO=C(CNCc1ccccc1Br)Nc1cccc(Cl)c1
InChIInChI=1S/C15H14BrClN2O/c16-14-7-2-1-4-11(14)9-18-10-15(20)19-13-6-3-5-12(17)8-13/h1-8,18H,9-10H2,(H,19,20)
InChIKeyXJVMREBGUWSJAQ-UHFFFAOYSA-N
MW353.65 g/mol
LogP3.83
Rot. Bonds5

About 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide

2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide (PubChem CID 61401955) has the molecular formula C15H14BrClN2O and a molecular weight of 353.65 g/mol. Its IUPAC name is 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide
PubChem CID61401955
Molecular FormulaC15H14BrClN2O
Molecular Weight353.65 g/mol
Exact Mass352.00
IUPAC Name2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide
SMILESO=C(CNCc1ccccc1Br)Nc1cccc(Cl)c1
InChIInChI=1S/C15H14BrClN2O/c16-14-7-2-1-4-11(14)9-18-10-15(20)19-13-6-3-5-12(17)8-13/h1-8,18H,9-10H2,(H,19,20)
InChIKeyXJVMREBGUWSJAQ-UHFFFAOYSA-N
XLogP3.83
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.65
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chlorophenyl)methylamino]-N-(3,5-dichlorophenyl)acetamide
CID 54832861
N-(3-chlorophenyl)-2-[(1,5-dimethylpyrazol-4-yl)methylamino]acetamide
CID 106044881
2-(4-bromo-3-chloroanilino)-N-(3-chlorophenyl)acetamide
CID 107619813
N-[3-[[2-(3-chloroanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54809062
2-(2-bromo-6-fluoroanilino)-N-(3-chlorophenyl)acetamide
CID 107599222
N-(3-chlorophenyl)-2-(2,2-dimethylpropylamino)acetamide
CID 61168620
2-(3-bromo-5-methylanilino)-N-(3-chlorophenyl)acetamide
CID 107583061
N-(4-bromo-3-methylphenyl)-2-[(2-methylphenyl)methylamino]acetamide
CID 108996610
N-(3-chlorophenyl)-2-[(5-ethylthiophen-2-yl)methylamino]acetamide
CID 106011028
(Z)-3-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)-2-cyanoprop-2-enamide
CID 108860604
N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide
CID 103820250
2-(3-chloroanilino)-N-(3,5-dichlorophenyl)acetamide
CID 54809235

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide (CID 61401955) is 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide is O=C(CNCc1ccccc1Br)Nc1cccc(Cl)c1.
What is the InChIKey of 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide?
The InChIKey is XJVMREBGUWSJAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2O/c16-14-7-2-1-4-11(14)9-18-10-15(20)19-13-6-3-5-12(17)8-13/h1-8,18H,9-10H2,(H,19,20).
What are the key properties of 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide?
2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide has a molecular weight of 353.65 g/mol, XLogP of 3.83, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromophenyl)methylamino]-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 61401955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).