[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine

C14H17N3S — CID 105327009

IUPAC[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine
SMILESNNC(c1cccc2ncccc12)C1CCSC1
InChIInChI=1S/C14H17N3S/c15-17-14(10-6-8-18-9-10)12-3-1-5-13-11(12)4-2-7-16-13/h1-5,7,10,14,17H,6,8-9,15H2
InChIKeyVFVGCGLYXQGJSP-UHFFFAOYSA-N
MW259.38 g/mol
LogP2.49
Rot. Bonds3

About [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine

[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine (PubChem CID 105327009) has the molecular formula C14H17N3S and a molecular weight of 259.38 g/mol. Its IUPAC name is [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine
PubChem CID105327009
Molecular FormulaC14H17N3S
Molecular Weight259.38 g/mol
Exact Mass259.11
IUPAC Name[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine
SMILESNNC(c1cccc2ncccc12)C1CCSC1
InChIInChI=1S/C14H17N3S/c15-17-14(10-6-8-18-9-10)12-3-1-5-13-11(12)4-2-7-16-13/h1-5,7,10,14,17H,6,8-9,15H2
InChIKeyVFVGCGLYXQGJSP-UHFFFAOYSA-N
XLogP2.49
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 52.49
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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Related Compounds

[(2,3-dichlorophenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105301765
[(5-methyloxolan-2-yl)-quinolin-5-ylmethyl]hydrazine
CID 105326995
N-methyl-1-quinolin-5-yl-2-(thian-4-yl)ethanamine
CID 105171945
[7-bicyclo[4.2.0]octa-1,3,5-trienyl(quinolin-5-yl)methyl]hydrazine
CID 105224816
[quinolin-3-yl(thiolan-3-yl)methyl]hydrazine
CID 105286981
2-cyclopropyl-1-quinolin-5-ylethanamine
CID 79015948
[phenyl(quinolin-5-yl)methyl]hydrazine
CID 105199350
[1-benzofuran-2-yl(thiolan-3-yl)methyl]hydrazine
CID 105337847
1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020098
quinolin-5-yl(thiolan-2-yl)methanamine
CID 81224263
[thiolan-3-yl-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710499
1-(5,6-dimethyl-1,4-dithian-2-yl)-N-methyl-1-quinolin-5-ylmethanamine
CID 103345763

Frequently Asked Questions

What is the IUPAC name of [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine?
The IUPAC name of [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine (CID 105327009) is [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine?
The canonical SMILES for [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine is NNC(c1cccc2ncccc12)C1CCSC1.
What is the InChIKey of [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine?
The InChIKey is VFVGCGLYXQGJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3S/c15-17-14(10-6-8-18-9-10)12-3-1-5-13-11(12)4-2-7-16-13/h1-5,7,10,14,17H,6,8-9,15H2.
What are the key properties of [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine?
[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine has a molecular weight of 259.38 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [quinolin-5-yl(thiolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105327009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).