N-(2,6-dibromophenyl)-4-methoxybenzohydrazide

C14H12Br2N2O2 — CID 174761412

IUPACN-(2,6-dibromophenyl)-4-methoxybenzohydrazide
SMILESCOc1ccc(C(=O)N(N)c2c(Br)cccc2Br)cc1
InChIInChI=1S/C14H12Br2N2O2/c1-20-10-7-5-9(6-8-10)14(19)18(17)13-11(15)3-2-4-12(13)16/h2-8H,17H2,1H3
InChIKeyQDXOGDBYEGUAME-UHFFFAOYSA-N
MW400.07 g/mol
LogP3.74
Rot. Bonds3

About N-(2,6-dibromophenyl)-4-methoxybenzohydrazide

N-(2,6-dibromophenyl)-4-methoxybenzohydrazide (PubChem CID 174761412) has the molecular formula C14H12Br2N2O2 and a molecular weight of 400.07 g/mol. Its IUPAC name is N-(2,6-dibromophenyl)-4-methoxybenzohydrazide.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)-4-methoxybenzohydrazide
PubChem CID174761412
Molecular FormulaC14H12Br2N2O2
Molecular Weight400.07 g/mol
Exact Mass397.93
IUPAC NameN-(2,6-dibromophenyl)-4-methoxybenzohydrazide
SMILESCOc1ccc(C(=O)N(N)c2c(Br)cccc2Br)cc1
InChIInChI=1S/C14H12Br2N2O2/c1-20-10-7-5-9(6-8-10)14(19)18(17)13-11(15)3-2-4-12(13)16/h2-8H,17H2,1H3
InChIKeyQDXOGDBYEGUAME-UHFFFAOYSA-N
XLogP3.74
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.07
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide
CID 174761410
4-methoxy-N'-(4-methoxybenzoyl)-N,N'-dimethylbenzohydrazide
CID 14949074
4-methoxy-N-methyl-N-oxidobenzamide
CID 15105733
azane;2-bromo-1-(4-methoxyphenyl)ethanone
CID 118975954
2-(2-bromophenyl)sulfanyl-1-(4-methoxyphenyl)propan-1-one
CID 43232307
N-(2-bromophenyl)-4-methoxybenzamide
CID 5176555
4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
CID 23508483
(4-bromophenyl)-(4-methoxyphenyl)methanone
CID 794333
N-benzyl-N-(2-bromoethyl)-4-methoxybenzamide
CID 80656055
6-methoxy-N-methylnaphthalene-2-carbohydrazide
CID 116845699
(4-methoxyphenyl)-tris(4-methoxybenzoyl)germylmethanone
CID 140911136
N-(3-aminopropyl)-N-ethyl-4-methoxybenzamide
CID 43136513

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)-4-methoxybenzohydrazide?
The IUPAC name of N-(2,6-dibromophenyl)-4-methoxybenzohydrazide (CID 174761412) is N-(2,6-dibromophenyl)-4-methoxybenzohydrazide.
What is the SMILES notation for N-(2,6-dibromophenyl)-4-methoxybenzohydrazide?
The canonical SMILES for N-(2,6-dibromophenyl)-4-methoxybenzohydrazide is COc1ccc(C(=O)N(N)c2c(Br)cccc2Br)cc1.
What is the InChIKey of N-(2,6-dibromophenyl)-4-methoxybenzohydrazide?
The InChIKey is QDXOGDBYEGUAME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Br2N2O2/c1-20-10-7-5-9(6-8-10)14(19)18(17)13-11(15)3-2-4-12(13)16/h2-8H,17H2,1H3.
What are the key properties of N-(2,6-dibromophenyl)-4-methoxybenzohydrazide?
N-(2,6-dibromophenyl)-4-methoxybenzohydrazide has a molecular weight of 400.07 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dibromophenyl)-4-methoxybenzohydrazide is sourced from PubChem (CID 174761412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).