[5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine

C10H10IN3OS — CID 79763915

IUPAC[5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COc2ccc(I)cc2)s1
InChIInChI=1S/C10H10IN3OS/c11-7-1-3-8(4-2-7)15-6-9-5-13-10(14-12)16-9/h1-5H,6,12H2,(H,13,14)
InChIKeyCYXVFCSEVBXFDD-UHFFFAOYSA-N
MW347.18 g/mol
LogP2.61
Rot. Bonds4

About [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine

[5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine (PubChem CID 79763915) has the molecular formula C10H10IN3OS and a molecular weight of 347.18 g/mol. Its IUPAC name is [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
PubChem CID79763915
Molecular FormulaC10H10IN3OS
Molecular Weight347.18 g/mol
Exact Mass346.96
IUPAC Name[5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COc2ccc(I)cc2)s1
InChIInChI=1S/C10H10IN3OS/c11-7-1-3-8(4-2-7)15-6-9-5-13-10(14-12)16-9/h1-5H,6,12H2,(H,13,14)
InChIKeyCYXVFCSEVBXFDD-UHFFFAOYSA-N
XLogP2.61
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.18
LogP ≤ 52.61
H-Bond Donors ≤ 52
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

[5-[(4-nitrophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79764786
[5-[(3,5-dimethoxyphenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79764026
[5-[(4-chloro-3-ethylphenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765304
[5-(ethoxymethyl)-1,3-thiazol-2-yl]hydrazine
CID 79765698
[5-(cyclopropylmethoxymethyl)-1,3-thiazol-2-yl]hydrazine
CID 79764792
[5-[(2,6-dimethoxyphenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765829
[5-(naphthalen-1-yloxymethyl)-1,3-thiazol-2-yl]hydrazine
CID 79764794
[5-[(2,3-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765837
[5-[(2,4-dibromophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765443
[5-[(2,5-dichlorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79764788
[5-[(2-propoxyphenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79765055
[5-[(2,5-dimethylphenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79764668

Frequently Asked Questions

What is the IUPAC name of [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine (CID 79763915) is [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine is NNc1ncc(COc2ccc(I)cc2)s1.
What is the InChIKey of [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine?
The InChIKey is CYXVFCSEVBXFDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10IN3OS/c11-7-1-3-8(4-2-7)15-6-9-5-13-10(14-12)16-9/h1-5H,6,12H2,(H,13,14).
What are the key properties of [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine?
[5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine has a molecular weight of 347.18 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(4-iodophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79763915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).