5-bromonaphthalene-1-carbohydrazide

C11H9BrN2O — CID 22115886

IUPAC5-bromonaphthalene-1-carbohydrazide
SMILESNNC(=O)c1cccc2c(Br)cccc12
InChIInChI=1S/C11H9BrN2O/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(15)14-13/h1-6H,13H2,(H,14,15)
InChIKeyGUNFWPBYWGACRX-UHFFFAOYSA-N
MW265.11 g/mol
LogP2.21
Rot. Bonds1

About 5-bromonaphthalene-1-carbohydrazide

5-bromonaphthalene-1-carbohydrazide (PubChem CID 22115886) has the molecular formula C11H9BrN2O and a molecular weight of 265.11 g/mol. Its IUPAC name is 5-bromonaphthalene-1-carbohydrazide.

Molecular Properties

Compound Name5-bromonaphthalene-1-carbohydrazide
PubChem CID22115886
Molecular FormulaC11H9BrN2O
Molecular Weight265.11 g/mol
Exact Mass263.99
IUPAC Name5-bromonaphthalene-1-carbohydrazide
SMILESNNC(=O)c1cccc2c(Br)cccc12
InChIInChI=1S/C11H9BrN2O/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(15)14-13/h1-6H,13H2,(H,14,15)
InChIKeyGUNFWPBYWGACRX-UHFFFAOYSA-N
XLogP2.21
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.11
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

5-bromo-N-[4-(2-methylpropanoylamino)phenyl]naphthalene-1-carboxamide
CID 1298059
5-bromonaphthalene-1-carboxylic acid;(5-bromonaphthalen-1-yl)methanol
CID 158385324
5-bromo-N-(2-hydroxy-4,5-dimethylphenyl)naphthalene-1-carboxamide
CID 3491041
5-bromo-N-(4-bromo-2-methylphenyl)naphthalene-1-carboxamide
CID 3475796
N'-(2,6-dibromophenyl)-N-[2-(hydrazinecarbonyl)phenyl]oxamide
CID 19845065
2-chloro-3-hydroxybenzohydrazide
CID 59092296
5-bromo-N-(2-fluoro-4-iodophenyl)naphthalene-1-carboxamide
CID 17111228
dimethyl 5-[(5-bromonaphthalene-1-carbonyl)amino]benzene-1,3-dicarboxylate
CID 1354324
1H-indole-4-carbohydrazide
CID 43316644
5-bromo-N-(1-methyltetrazol-5-yl)naphthalene-1-carboxamide
CID 925603
5-bromo-N-(pyridin-3-ylmethylcarbamothioyl)naphthalene-1-carboxamide
CID 1048047
2-[3-[2-(hydrazinecarbonyl)phenyl]-3-oxopropanoyl]benzohydrazide
CID 141301620

Frequently Asked Questions

What is the IUPAC name of 5-bromonaphthalene-1-carbohydrazide?
The IUPAC name of 5-bromonaphthalene-1-carbohydrazide (CID 22115886) is 5-bromonaphthalene-1-carbohydrazide.
What is the SMILES notation for 5-bromonaphthalene-1-carbohydrazide?
The canonical SMILES for 5-bromonaphthalene-1-carbohydrazide is NNC(=O)c1cccc2c(Br)cccc12.
What is the InChIKey of 5-bromonaphthalene-1-carbohydrazide?
The InChIKey is GUNFWPBYWGACRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN2O/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(15)14-13/h1-6H,13H2,(H,14,15).
What are the key properties of 5-bromonaphthalene-1-carbohydrazide?
5-bromonaphthalene-1-carbohydrazide has a molecular weight of 265.11 g/mol, XLogP of 2.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromonaphthalene-1-carbohydrazide is sourced from PubChem (CID 22115886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).