1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine

C9H11N3S — CID 2306203

IUPAC1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine
SMILESc1ccc(NNC2=NCCS2)cc1
InChIInChI=1S/C9H11N3S/c1-2-4-8(5-3-1)11-12-9-10-6-7-13-9/h1-5,11H,6-7H2,(H,10,12)
InChIKeyKTOMRFWBRXKQDH-UHFFFAOYSA-N
MW193.28 g/mol
LogP1.71
Rot. Bonds2

About 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine

1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine (PubChem CID 2306203) has the molecular formula C9H11N3S and a molecular weight of 193.28 g/mol. Its IUPAC name is 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine.

Molecular Properties

Compound Name1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine
PubChem CID2306203
Molecular FormulaC9H11N3S
Molecular Weight193.28 g/mol
Exact Mass193.07
IUPAC Name1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine
SMILESc1ccc(NNC2=NCCS2)cc1
InChIInChI=1S/C9H11N3S/c1-2-4-8(5-3-1)11-12-9-10-6-7-13-9/h1-5,11H,6-7H2,(H,10,12)
InChIKeyKTOMRFWBRXKQDH-UHFFFAOYSA-N
XLogP1.71
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.28
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine?
The IUPAC name of 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine (CID 2306203) is 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine.
What is the SMILES notation for 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine?
The canonical SMILES for 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine is c1ccc(NNC2=NCCS2)cc1.
What is the InChIKey of 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine?
The InChIKey is KTOMRFWBRXKQDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3S/c1-2-4-8(5-3-1)11-12-9-10-6-7-13-9/h1-5,11H,6-7H2,(H,10,12).
What are the key properties of 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine?
1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine has a molecular weight of 193.28 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dihydro-1,3-thiazol-2-yl)-2-phenylhydrazine is sourced from PubChem (CID 2306203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).