N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide

C14H12Br2N2O2 — CID 107670590

IUPACN-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)Nc1c(N)cc(Br)cc1Br
InChIInChI=1S/C14H12Br2N2O2/c1-7-4-9(19)2-3-10(7)14(20)18-13-11(16)5-8(15)6-12(13)17/h2-6,19H,17H2,1H3,(H,18,20)
InChIKeyDKJYHISFQNOCKH-UHFFFAOYSA-N
MW400.07 g/mol
LogP4.06
Rot. Bonds2

About N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide

N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide (PubChem CID 107670590) has the molecular formula C14H12Br2N2O2 and a molecular weight of 400.07 g/mol. Its IUPAC name is N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide
PubChem CID107670590
Molecular FormulaC14H12Br2N2O2
Molecular Weight400.07 g/mol
Exact Mass397.93
IUPAC NameN-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)Nc1c(N)cc(Br)cc1Br
InChIInChI=1S/C14H12Br2N2O2/c1-7-4-9(19)2-3-10(7)14(20)18-13-11(16)5-8(15)6-12(13)17/h2-6,19H,17H2,1H3,(H,18,20)
InChIKeyDKJYHISFQNOCKH-UHFFFAOYSA-N
XLogP4.06
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.07
LogP ≤ 54.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-4,6-dibromophenyl)-5-fluoro-2-methylbenzamide
CID 63047885
2-amino-4-bromo-N-(4-hydroxy-2-methylphenyl)benzamide
CID 79723167
4-amino-3-methyl-N-(2,4,6-tribromophenyl)benzamide
CID 28991635
N-(2-amino-4,6-dibromophenyl)-2-methoxy-5-methylbenzamide
CID 62504201
N-(2-amino-4,6-dibromophenyl)-2-methylsulfanylbenzamide
CID 79215660
4-hydroxy-2-methyl-N-(2,4,6-trimethylphenyl)benzamide
CID 103863704
N-(2-amino-4-bromo-6-methylphenyl)-4-chloro-2-fluorobenzamide
CID 43549986
N-(2-amino-4,6-dibromophenyl)benzamide
CID 43548444
3-amino-5-bromo-N-(2,6-dimethylphenyl)-2-methylbenzamide
CID 107872047
3-amino-5-bromo-N-(2,6-dibromophenyl)-2-methylbenzamide
CID 107873304
N-(2-amino-4-bromo-6-methylphenyl)-2-hydroxy-5-methylbenzamide
CID 43549991
N-(2-amino-4-bromo-6-methylphenyl)-2,4-dichlorobenzamide
CID 43549936

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide?
The IUPAC name of N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide (CID 107670590) is N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide?
The canonical SMILES for N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide is Cc1cc(O)ccc1C(=O)Nc1c(N)cc(Br)cc1Br.
What is the InChIKey of N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide?
The InChIKey is DKJYHISFQNOCKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Br2N2O2/c1-7-4-9(19)2-3-10(7)14(20)18-13-11(16)5-8(15)6-12(13)17/h2-6,19H,17H2,1H3,(H,18,20).
What are the key properties of N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide?
N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide has a molecular weight of 400.07 g/mol, XLogP of 4.06, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4,6-dibromophenyl)-4-hydroxy-2-methylbenzamide is sourced from PubChem (CID 107670590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).