[3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine

C9H13N3OS — CID 164652296

IUPAC[3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine
SMILESNNC(c1ccsn1)C12COCC1C2
InChIInChI=1S/C9H13N3OS/c10-11-8(7-1-2-14-12-7)9-3-6(9)4-13-5-9/h1-2,6,8,11H,3-5,10H2
InChIKeyBQEQMBHXEGKUJN-UHFFFAOYSA-N
MW211.29 g/mol
LogP0.68
Rot. Bonds3

About [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine

[3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine (PubChem CID 164652296) has the molecular formula C9H13N3OS and a molecular weight of 211.29 g/mol. Its IUPAC name is [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine
PubChem CID164652296
Molecular FormulaC9H13N3OS
Molecular Weight211.29 g/mol
Exact Mass211.08
IUPAC Name[3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine
SMILESNNC(c1ccsn1)C12COCC1C2
InChIInChI=1S/C9H13N3OS/c10-11-8(7-1-2-14-12-7)9-3-6(9)4-13-5-9/h1-2,6,8,11H,3-5,10H2
InChIKeyBQEQMBHXEGKUJN-UHFFFAOYSA-N
XLogP0.68
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[Oxolan-3-yl(1,2-thiazol-3-yl)methyl]hydrazine
CID 130604763
(3-Methyloxan-4-yl)-(1,2-thiazol-3-yl)methanamine
CID 130604775
[(2-Methyloxolan-3-yl)-(1,2-thiazol-3-yl)methyl]hydrazine
CID 130604837
[(2-Methyloxolan-2-yl)-(1,2-thiazol-3-yl)methyl]hydrazine
CID 130642505
2-(Oxolan-3-yl)-1-(1,2-thiazol-3-yl)ethanamine
CID 130649338
Oxolan-3-yl(1,2-thiazol-3-yl)methanamine
CID 130664721
(2-Ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanamine
CID 130840669
[Oxan-3-yl(1,2-thiazol-3-yl)methyl]hydrazine
CID 130848693
[3-Oxabicyclo[3.1.0]hexan-6-yl(1,2-thiazol-5-yl)methyl]hydrazine
CID 130942800
[3-Oxabicyclo[3.1.0]hexan-6-yl(1,2-thiazol-3-yl)methyl]hydrazine
CID 130992685
(2-Methyloxolan-3-yl)-(1,2-thiazol-3-yl)methanamine
CID 131182016

Frequently Asked Questions

What is the IUPAC name of [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine?
The IUPAC name of [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine (CID 164652296) is [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine.
What is the SMILES notation for [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine?
The canonical SMILES for [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine is NNC(c1ccsn1)C12COCC1C2.
What is the InChIKey of [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine?
The InChIKey is BQEQMBHXEGKUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3OS/c10-11-8(7-1-2-14-12-7)9-3-6(9)4-13-5-9/h1-2,6,8,11H,3-5,10H2.
What are the key properties of [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine?
[3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine has a molecular weight of 211.29 g/mol, XLogP of 0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-oxabicyclo[3.1.0]hexan-1-yl(1,2-thiazol-3-yl)methyl]hydrazine is sourced from PubChem (CID 164652296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).