1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine

C9H17N3S — CID 105202230

IUPAC1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine
SMILESCCCC(Cc1csc(C)n1)NN
InChIInChI=1S/C9H17N3S/c1-3-4-8(12-10)5-9-6-13-7(2)11-9/h6,8,12H,3-5,10H2,1-2H3
InChIKeyJSRFINPFSFYDKB-UHFFFAOYSA-N
MW199.32 g/mol
LogP1.63
Rot. Bonds5

About 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine

1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine (PubChem CID 105202230) has the molecular formula C9H17N3S and a molecular weight of 199.32 g/mol. Its IUPAC name is 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine.

Molecular Properties

Compound Name1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine
PubChem CID105202230
Molecular FormulaC9H17N3S
Molecular Weight199.32 g/mol
Exact Mass199.11
IUPAC Name1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine
SMILESCCCC(Cc1csc(C)n1)NN
InChIInChI=1S/C9H17N3S/c1-3-4-8(12-10)5-9-6-13-7(2)11-9/h6,8,12H,3-5,10H2,1-2H3
InChIKeyJSRFINPFSFYDKB-UHFFFAOYSA-N
XLogP1.63
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 51.63
H-Bond Donors ≤ 52
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-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine?
The IUPAC name of 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine (CID 105202230) is 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine.
What is the SMILES notation for 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine?
The canonical SMILES for 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine is CCCC(Cc1csc(C)n1)NN.
What is the InChIKey of 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine?
The InChIKey is JSRFINPFSFYDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3S/c1-3-4-8(12-10)5-9-6-13-7(2)11-9/h6,8,12H,3-5,10H2,1-2H3.
What are the key properties of 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine?
1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine has a molecular weight of 199.32 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1,3-thiazol-4-yl)pentan-2-ylhydrazine is sourced from PubChem (CID 105202230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).