N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide

C15H13BrN2O2 — CID 144653099

IUPACN'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide
SMILESCN(Nc1ccc(Br)cc1)C(=O)c1ccccc1C=O
InChIInChI=1S/C15H13BrN2O2/c1-18(17-13-8-6-12(16)7-9-13)15(20)14-5-3-2-4-11(14)10-19/h2-10,17H,1H3
InChIKeyWGTRNPGWBKXMOG-UHFFFAOYSA-N
MW333.19 g/mol
LogP3.36
Rot. Bonds4

About N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide

N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide (PubChem CID 144653099) has the molecular formula C15H13BrN2O2 and a molecular weight of 333.19 g/mol. Its IUPAC name is N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide.

Molecular Properties

Compound NameN'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide
PubChem CID144653099
Molecular FormulaC15H13BrN2O2
Molecular Weight333.19 g/mol
Exact Mass332.02
IUPAC NameN'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide
SMILESCN(Nc1ccc(Br)cc1)C(=O)c1ccccc1C=O
InChIInChI=1S/C15H13BrN2O2/c1-18(17-13-8-6-12(16)7-9-13)15(20)14-5-3-2-4-11(14)10-19/h2-10,17H,1H3
InChIKeyWGTRNPGWBKXMOG-UHFFFAOYSA-N
XLogP3.36
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.19
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[(2-formylbenzoyl)-methylamino] thiohypofluorite
CID 155149630
2-formyl-N-heptyl-N-methylbenzamide
CID 144774360
2-formyl-N,N-dimethylbenzenecarboximidamide
CID 57076481
N'-[[dimethylamino(methyl)amino]-methylamino]-2-formyl-N'-methylbenzohydrazide
CID 155241258
ethane;2-formyl-N-methyl-N-[1-(methylamino)-1,5-dioxopentan-2-yl]benzamide
CID 171641510
N-(4-aminocyclohexyl)sulfanyl-2-formyl-N-methylbenzamide;ethane
CID 142541818
N-(2-bromoethyl)-2-formylbenzamide
CID 18508334
2-formylbenzoyl iodide
CID 88830490
N-(4-bromophenyl)-2-(2-formylphenoxy)acetamide
CID 7128222
N-[2-(7-bromo-2-chloroquinolin-3-yl)ethyl]-2-formyl-N-methylbenzamide;ethane
CID 155732148
2-formylbenzoic acid;methoxymethane
CID 90858085
N-[(E,2Z)-4-amino-2-[amino(chloro)methylidene]-4-hydroxybut-3-enyl]-2-formyl-N-methylbenzamide
CID 146252180

Frequently Asked Questions

What is the IUPAC name of N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide?
The IUPAC name of N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide (CID 144653099) is N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide.
What is the SMILES notation for N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide?
The canonical SMILES for N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide is CN(Nc1ccc(Br)cc1)C(=O)c1ccccc1C=O.
What is the InChIKey of N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide?
The InChIKey is WGTRNPGWBKXMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O2/c1-18(17-13-8-6-12(16)7-9-13)15(20)14-5-3-2-4-11(14)10-19/h2-10,17H,1H3.
What are the key properties of N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide?
N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide has a molecular weight of 333.19 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-bromophenyl)-2-formyl-N-methylbenzohydrazide is sourced from PubChem (CID 144653099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).