1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine

C10H17N3S — CID 141220598

IUPAC1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine
SMILESCCCN(N)C1CCc2ncsc2C1
InChIInChI=1S/C10H17N3S/c1-2-5-13(11)8-3-4-9-10(6-8)14-7-12-9/h7-8H,2-6,11H2,1H3
InChIKeyZLGOAIFIUBQTEU-UHFFFAOYSA-N
MW211.33 g/mol
LogP1.59
Rot. Bonds3

About 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine

1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine (PubChem CID 141220598) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine.

Molecular Properties

Compound Name1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine
PubChem CID141220598
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine
SMILESCCCN(N)C1CCc2ncsc2C1
InChIInChI=1S/C10H17N3S/c1-2-5-13(11)8-3-4-9-10(6-8)14-7-12-9/h7-8H,2-6,11H2,1H3
InChIKeyZLGOAIFIUBQTEU-UHFFFAOYSA-N
XLogP1.59
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine?
The IUPAC name of 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine (CID 141220598) is 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine.
What is the SMILES notation for 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine?
The canonical SMILES for 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine is CCCN(N)C1CCc2ncsc2C1.
What is the InChIKey of 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine?
The InChIKey is ZLGOAIFIUBQTEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-2-5-13(11)8-3-4-9-10(6-8)14-7-12-9/h7-8H,2-6,11H2,1H3.
What are the key properties of 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine?
1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine has a molecular weight of 211.33 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-1-(4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)hydrazine is sourced from PubChem (CID 141220598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).