N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide

C12H10ClIN4O — CID 107606116

IUPACN-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide
SMILESNNc1cnccc1C(=O)Nc1ccc(I)cc1Cl
InChIInChI=1S/C12H10ClIN4O/c13-9-5-7(14)1-2-10(9)17-12(19)8-3-4-16-6-11(8)18-15/h1-6,18H,15H2,(H,17,19)
InChIKeyCWNTYPKVGLWEBM-UHFFFAOYSA-N
MW388.60 g/mol
LogP2.88
Rot. Bonds3

About N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide

N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide (PubChem CID 107606116) has the molecular formula C12H10ClIN4O and a molecular weight of 388.60 g/mol. Its IUPAC name is N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide
PubChem CID107606116
Molecular FormulaC12H10ClIN4O
Molecular Weight388.60 g/mol
Exact Mass387.96
IUPAC NameN-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide
SMILESNNc1cnccc1C(=O)Nc1ccc(I)cc1Cl
InChIInChI=1S/C12H10ClIN4O/c13-9-5-7(14)1-2-10(9)17-12(19)8-3-4-16-6-11(8)18-15/h1-6,18H,15H2,(H,17,19)
InChIKeyCWNTYPKVGLWEBM-UHFFFAOYSA-N
XLogP2.88
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.60
LogP ≤ 52.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

N-(2-chloro-4-cyanophenyl)-3-hydrazinylpyridine-4-carboxamide
CID 107810316
5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide
CID 107606119
3-hydrazinyl-N-pyridin-4-ylpyridine-4-carboxamide
CID 105071908
N-(2-chloro-4-iodophenyl)-4-(propylamino)pyridine-3-carboxamide
CID 107606051
N-(3-fluoro-4-pyridinyl)-3-hydrazinylpyridine-4-carboxamide
CID 107595570
N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 107606112
2-amino-5-chloro-N-(2-chloro-4-iodophenyl)pyridine-4-carboxamide
CID 107606018
3-(2-chloro-4-iodoanilino)-N-phenylmethoxypyridine-4-carboxamide
CID 11677348
3-amino-N-(2-chloro-4-methylphenyl)pyridine-4-carboxamide
CID 105068439
N-(2-chloro-4-methylphenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105068441
1-amino-3-(2-chloro-4-iodophenyl)urea
CID 107605938
N-(2-cyano-4-fluorophenyl)-3-hydrazinylpyridine-4-carboxamide
CID 105072391

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide (CID 107606116) is N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide is NNc1cnccc1C(=O)Nc1ccc(I)cc1Cl.
What is the InChIKey of N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide?
The InChIKey is CWNTYPKVGLWEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClIN4O/c13-9-5-7(14)1-2-10(9)17-12(19)8-3-4-16-6-11(8)18-15/h1-6,18H,15H2,(H,17,19).
What are the key properties of N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide?
N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide has a molecular weight of 388.60 g/mol, XLogP of 2.88, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 107606116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).