[quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine

C13H12N4S — CID 105253658

IUPAC[quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine
SMILESNNC(c1cncs1)c1cccc2cccnc12
InChIInChI=1S/C13H12N4S/c14-17-13(11-7-15-8-18-11)10-5-1-3-9-4-2-6-16-12(9)10/h1-8,13,17H,14H2
InChIKeyAHQKWFFXECTDMJ-UHFFFAOYSA-N
MW256.33 g/mol
LogP2.24
Rot. Bonds3

About [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine

[quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine (PubChem CID 105253658) has the molecular formula C13H12N4S and a molecular weight of 256.33 g/mol. Its IUPAC name is [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine
PubChem CID105253658
Molecular FormulaC13H12N4S
Molecular Weight256.33 g/mol
Exact Mass256.08
IUPAC Name[quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine
SMILESNNC(c1cncs1)c1cccc2cccnc12
InChIInChI=1S/C13H12N4S/c14-17-13(11-7-15-8-18-11)10-5-1-3-9-4-2-6-16-12(9)10/h1-8,13,17H,14H2
InChIKeyAHQKWFFXECTDMJ-UHFFFAOYSA-N
XLogP2.24
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 52.24
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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Frequently Asked Questions

What is the IUPAC name of [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine?
The IUPAC name of [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine (CID 105253658) is [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine?
The canonical SMILES for [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine is NNC(c1cncs1)c1cccc2cccnc12.
What is the InChIKey of [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine?
The InChIKey is AHQKWFFXECTDMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4S/c14-17-13(11-7-15-8-18-11)10-5-1-3-9-4-2-6-16-12(9)10/h1-8,13,17H,14H2.
What are the key properties of [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine?
[quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine has a molecular weight of 256.33 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105253658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).