[2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine

C9H8IN3O — CID 58767121

IUPAC[2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine
SMILESNNc1ccc(-c2cnco2)cc1I
InChIInChI=1S/C9H8IN3O/c10-7-3-6(1-2-8(7)13-11)9-4-12-5-14-9/h1-5,13H,11H2
InChIKeyWPILPSWXPXSRSO-UHFFFAOYSA-N
MW301.09 g/mol
LogP2.23
Rot. Bonds2

About [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine

[2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine (PubChem CID 58767121) has the molecular formula C9H8IN3O and a molecular weight of 301.09 g/mol. Its IUPAC name is [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine.

Molecular Properties

Compound Name[2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine
PubChem CID58767121
Molecular FormulaC9H8IN3O
Molecular Weight301.09 g/mol
Exact Mass300.97
IUPAC Name[2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine
SMILESNNc1ccc(-c2cnco2)cc1I
InChIInChI=1S/C9H8IN3O/c10-7-3-6(1-2-8(7)13-11)9-4-12-5-14-9/h1-5,13H,11H2
InChIKeyWPILPSWXPXSRSO-UHFFFAOYSA-N
XLogP2.23
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.09
LogP ≤ 52.23
H-Bond Donors ≤ 52
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'}

Analyze [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]phenyl]hydrazine
CID 59004533
5-(6-chloro-3-pyridinyl)-1,3-oxazole
CID 2766284
5-(4-bromophenyl)-1,3-oxazole
CID 2776418
benzene;5-phenyl-1,3-oxazole
CID 69095044
5-[4-(4-chlorophenyl)phenyl]-1,3-oxazole
CID 21408358
5-(4-methylphenyl)-1,3-oxazole;4-(1,3-oxazol-5-yl)aniline
CID 159378893
methyl 2-methoxy-5-(1,3-oxazol-5-yl)benzoate
CID 118720203
5-(6-methoxynaphthalen-2-yl)-1,3-oxazole
CID 154354480
[2-(4-iodo-2-methylanilino)-2-oxoethyl] 4-(1,3-oxazol-5-yl)benzoate
CID 55996026
2-[3-(1,3-oxazol-5-yl)phenyl]guanidine
CID 69055551
[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]hydrazine
CID 23106631
5-(3,5-dibromophenyl)-1,3-oxazole
CID 91400423

Frequently Asked Questions

What is the IUPAC name of [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine?
The IUPAC name of [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine (CID 58767121) is [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine.
What is the SMILES notation for [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine?
The canonical SMILES for [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine is NNc1ccc(-c2cnco2)cc1I.
What is the InChIKey of [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine?
The InChIKey is WPILPSWXPXSRSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8IN3O/c10-7-3-6(1-2-8(7)13-11)9-4-12-5-14-9/h1-5,13H,11H2.
What are the key properties of [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine?
[2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine has a molecular weight of 301.09 g/mol, XLogP of 2.23, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-iodo-4-(1,3-oxazol-5-yl)phenyl]hydrazine is sourced from PubChem (CID 58767121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).