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

C11H10N4OS — CID 116892127

IUPAC[2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine
SMILESCc1nc2cc(-c3nc(NN)cs3)ccc2o1
InChIInChI=1S/C11H10N4OS/c1-6-13-8-4-7(2-3-9(8)16-6)11-14-10(15-12)5-17-11/h2-5,15H,12H2,1H3
InChIKeyYGDZCBDRSRLGJB-UHFFFAOYSA-N
MW246.30 g/mol
LogP2.55
Rot. Bonds2

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

[2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine (PubChem CID 116892127) has the molecular formula C11H10N4OS and a molecular weight of 246.30 g/mol. Its IUPAC name is [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine
PubChem CID116892127
Molecular FormulaC11H10N4OS
Molecular Weight246.30 g/mol
Exact Mass246.06
IUPAC Name[2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine
SMILESCc1nc2cc(-c3nc(NN)cs3)ccc2o1
InChIInChI=1S/C11H10N4OS/c1-6-13-8-4-7(2-3-9(8)16-6)11-14-10(15-12)5-17-11/h2-5,15H,12H2,1H3
InChIKeyYGDZCBDRSRLGJB-UHFFFAOYSA-N
XLogP2.55
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.30
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazole-4-thiol
CID 116889685
2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazole-4-carboxamide
CID 116892007
5-[2-(bromomethyl)-1,3-thiazol-4-yl]-2-methyl-1,3-benzoxazole
CID 116970349
2-amino-4-(2-methyl-1,3-benzoxazol-5-yl)phenol
CID 58946383
[2-(4-chlorophenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892044
[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]hydrazine
CID 116892150
3-(2-methyl-1,3-benzoxazol-5-yl)-1,2-oxazol-5-amine
CID 82492852
6-[4-(chloromethyl)-1,3-thiazol-2-yl]-2-methyl-1,3-benzoxazole
CID 116888966
2-[4-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-2-yl]acetaldehyde
CID 116968865
hydrazinyl-(2-methyl-1,3-benzoxazol-5-yl)methanamine
CID 116947497
2-methyl-5-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1,3-benzoxazole
CID 53140993
[4-(2-methyl-1,3-benzoxazol-6-yl)-1,3-thiazol-2-yl]methylhydrazine
CID 116970222

Frequently Asked Questions

What is the IUPAC name of [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine?
The IUPAC name of [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine (CID 116892127) is [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine.
What is the SMILES notation for [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine?
The canonical SMILES for [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine is Cc1nc2cc(-c3nc(NN)cs3)ccc2o1.
What is the InChIKey of [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine?
The InChIKey is YGDZCBDRSRLGJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4OS/c1-6-13-8-4-7(2-3-9(8)16-6)11-14-10(15-12)5-17-11/h2-5,15H,12H2,1H3.
What are the key properties of [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine?
[2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine has a molecular weight of 246.30 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine is sourced from PubChem (CID 116892127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).