[5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine

C12H19N3OS — CID 105254577

IUPAC[5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine
SMILESNNC(c1cscn1)C1CCOC2(CCC2)C1
InChIInChI=1S/C12H19N3OS/c13-15-11(10-7-17-8-14-10)9-2-5-16-12(6-9)3-1-4-12/h7-9,11,15H,1-6,13H2
InChIKeyFYZRTEGEWOCFCW-UHFFFAOYSA-N
MW253.37 g/mol
LogP2.00
Rot. Bonds3

About [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine

[5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine (PubChem CID 105254577) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine
PubChem CID105254577
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC Name[5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine
SMILESNNC(c1cscn1)C1CCOC2(CCC2)C1
InChIInChI=1S/C12H19N3OS/c13-15-11(10-7-17-8-14-10)9-2-5-16-12(6-9)3-1-4-12/h7-9,11,15H,1-6,13H2
InChIKeyFYZRTEGEWOCFCW-UHFFFAOYSA-N
XLogP2.00
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 52.00
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

[1-oxa-9-thiaspiro[5.5]undecan-4-yl(1,3-thiazol-4-yl)methyl]hydrazine
CID 105254321
[5-oxaspiro[3.5]nonan-8-yl(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230654
[(4-methyl-2-pyridinyl)-(1-oxaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105220110
[(6-methoxypyrimidin-4-yl)-(6-oxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 102953258
[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105322157
[1-oxaspiro[5.5]undecan-4-yl(thiophen-2-yl)methyl]hydrazine
CID 105193759
[(2-iodophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105322205
[(3,5-dimethylcyclohexyl)-(1,3-thiazol-4-yl)methyl]hydrazine
CID 105254501
[(3,4-difluorophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105197240
[(5-methylthiophen-2-yl)-(6-oxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325423
[1-oxa-9-thiaspiro[5.5]undecan-4-yl(2H-triazol-4-yl)methyl]hydrazine
CID 105254675
[(2,5-dibromophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105322235

Frequently Asked Questions

What is the IUPAC name of [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine?
The IUPAC name of [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine (CID 105254577) is [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine?
The canonical SMILES for [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine is NNC(c1cscn1)C1CCOC2(CCC2)C1.
What is the InChIKey of [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine?
The InChIKey is FYZRTEGEWOCFCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c13-15-11(10-7-17-8-14-10)9-2-5-16-12(6-9)3-1-4-12/h7-9,11,15H,1-6,13H2.
What are the key properties of [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine?
[5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine has a molecular weight of 253.37 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-oxaspiro[3.5]nonan-8-yl(1,3-thiazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105254577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).