4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide

C14H14IN3O — CID 55162482

IUPAC4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide
SMILESCc1cc(C(=O)Nc2ccc(I)cc2)ccc1NN
InChIInChI=1S/C14H14IN3O/c1-9-8-10(2-7-13(9)18-16)14(19)17-12-5-3-11(15)4-6-12/h2-8,18H,16H2,1H3,(H,17,19)
InChIKeyVCXORWKWIUXZKD-UHFFFAOYSA-N
MW367.19 g/mol
LogP3.14
Rot. Bonds3

About 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide

4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide (PubChem CID 55162482) has the molecular formula C14H14IN3O and a molecular weight of 367.19 g/mol. Its IUPAC name is 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide
PubChem CID55162482
Molecular FormulaC14H14IN3O
Molecular Weight367.19 g/mol
Exact Mass367.02
IUPAC Name4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide
SMILESCc1cc(C(=O)Nc2ccc(I)cc2)ccc1NN
InChIInChI=1S/C14H14IN3O/c1-9-8-10(2-7-13(9)18-16)14(19)17-12-5-3-11(15)4-6-12/h2-8,18H,16H2,1H3,(H,17,19)
InChIKeyVCXORWKWIUXZKD-UHFFFAOYSA-N
XLogP3.14
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.19
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-hydrazinyl-N-(4-methoxyphenyl)-3-methylbenzamide
CID 63211736
N-(4-chloro-2-iodophenyl)-4-hydrazinyl-3-methylbenzamide
CID 107632237
N-(3-chloro-4-fluorophenyl)-4-hydrazinyl-3-methylbenzamide
CID 63211979
4-hydrazinyl-3-methyl-N-(2,4,5-trifluorophenyl)benzamide
CID 63212288
N-(2,5-dichloro-4-methylphenyl)-4-hydrazinyl-3-methylbenzamide
CID 104728259
4-hydrazinyl-3-methyl-N-pyridin-3-ylbenzamide
CID 63212144
4-iodo-N-[4-[(4-iodobenzoyl)amino]phenyl]benzamide
CID 4105689
N-(2-bromo-4-chlorophenyl)-4-hydrazinyl-3-methylbenzamide
CID 81275140
1-N,3-N,5-N-tris(4-iodophenyl)benzene-1,3,5-tricarboxamide
CID 102258249
4-fluoro-N-(4-iodo-2-methylphenyl)-3-methylbenzamide
CID 63213134
3,4-dimethyl-N-(4-methylphenyl)benzamide
CID 3950718
N-(2-bromo-5-chloro-4-methylphenyl)-4-hydrazinyl-3-methylbenzamide
CID 104725197

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide?
The IUPAC name of 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide (CID 55162482) is 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide.
What is the SMILES notation for 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide?
The canonical SMILES for 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide is Cc1cc(C(=O)Nc2ccc(I)cc2)ccc1NN.
What is the InChIKey of 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide?
The InChIKey is VCXORWKWIUXZKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14IN3O/c1-9-8-10(2-7-13(9)18-16)14(19)17-12-5-3-11(15)4-6-12/h2-8,18H,16H2,1H3,(H,17,19).
What are the key properties of 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide?
4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide has a molecular weight of 367.19 g/mol, XLogP of 3.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(4-iodophenyl)-3-methylbenzamide is sourced from PubChem (CID 55162482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).