N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide

C11H9ClIN5O — CID 107606112

IUPACN-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)Nc2ccc(I)cc2Cl)nn1
InChIInChI=1S/C11H9ClIN5O/c12-7-5-6(13)1-2-8(7)15-11(19)9-3-4-10(16-14)18-17-9/h1-5H,14H2,(H,15,19)(H,16,18)
InChIKeyDPMXMKAWYLUZNT-UHFFFAOYSA-N
MW389.58 g/mol
LogP2.27
Rot. Bonds3

About N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide

N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide (PubChem CID 107606112) has the molecular formula C11H9ClIN5O and a molecular weight of 389.58 g/mol. Its IUPAC name is N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide
PubChem CID107606112
Molecular FormulaC11H9ClIN5O
Molecular Weight389.58 g/mol
Exact Mass388.95
IUPAC NameN-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)Nc2ccc(I)cc2Cl)nn1
InChIInChI=1S/C11H9ClIN5O/c12-7-5-6(13)1-2-8(7)15-11(19)9-3-4-10(16-14)18-17-9/h1-5H,14H2,(H,15,19)(H,16,18)
InChIKeyDPMXMKAWYLUZNT-UHFFFAOYSA-N
XLogP2.27
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.58
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

6-chloro-N-(2-chloro-4-iodophenyl)pyridazine-3-carboxamide
CID 61052994
6-hydrazinyl-N-(2-iodophenyl)pyridazine-3-carboxamide
CID 62243106
5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide
CID 107606119
N-(2,4-difluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62247776
N-(3,5-dichloro-4-fluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 107578968
N-(2-chloro-4-iodophenyl)-3-hydrazinylpyridine-4-carboxamide
CID 107606116
1-amino-3-(2-chloro-4-iodophenyl)urea
CID 107605938
6-hydrazinyl-N-pyridin-4-ylpyridazine-3-carboxamide
CID 62242357
N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 62167689
N-(4-bromo-3-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 114261584
N-(4-bromo-2,5-difluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 107616833
N-(2-chloro-4-iodophenyl)acetamide
CID 18434368

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide?
The IUPAC name of N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide (CID 107606112) is N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide.
What is the SMILES notation for N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide?
The canonical SMILES for N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide is NNc1ccc(C(=O)Nc2ccc(I)cc2Cl)nn1.
What is the InChIKey of N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide?
The InChIKey is DPMXMKAWYLUZNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClIN5O/c12-7-5-6(13)1-2-8(7)15-11(19)9-3-4-10(16-14)18-17-9/h1-5H,14H2,(H,15,19)(H,16,18).
What are the key properties of N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide?
N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide has a molecular weight of 389.58 g/mol, XLogP of 2.27, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide is sourced from PubChem (CID 107606112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).