[6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine

C10H14N6S — CID 79232663

IUPAC[6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine
SMILESCc1nnc(SCc2cccc(NN)n2)n1C
InChIInChI=1S/C10H14N6S/c1-7-14-15-10(16(7)2)17-6-8-4-3-5-9(12-8)13-11/h3-5H,6,11H2,1-2H3,(H,12,13)
InChIKeyKTGLQFIYFLFUKI-UHFFFAOYSA-N
MW250.33 g/mol
LogP1.10
Rot. Bonds4

About [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine

[6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine (PubChem CID 79232663) has the molecular formula C10H14N6S and a molecular weight of 250.33 g/mol. Its IUPAC name is [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine
PubChem CID79232663
Molecular FormulaC10H14N6S
Molecular Weight250.33 g/mol
Exact Mass250.10
IUPAC Name[6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine
SMILESCc1nnc(SCc2cccc(NN)n2)n1C
InChIInChI=1S/C10H14N6S/c1-7-14-15-10(16(7)2)17-6-8-4-3-5-9(12-8)13-11/h3-5H,6,11H2,1-2H3,(H,12,13)
InChIKeyKTGLQFIYFLFUKI-UHFFFAOYSA-N
XLogP1.10
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

[6-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-pyridinyl]hydrazine
CID 79232113
3-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-methylaniline
CID 63537770
3-bromo-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]aniline
CID 55223020
2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridin-4-amine
CID 79260449
[6-(1,3-oxazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine
CID 106925681
3-[(3-fluorophenyl)methylsulfanyl]-4,5-dimethyl-1,2,4-triazole
CID 6464901
N-methyl-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]pyridin-2-amine
CID 79239132
3-[(6-hydrazinyl-2-pyridinyl)methylsulfanyl]phenol
CID 104591146
[6-[(2-methylphenyl)methylsulfanylmethyl]-2-pyridinyl]hydrazine
CID 79233187
2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methylquinoxaline
CID 17399209
[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 63482049
[5-[(4,5-dimethyl-1,2,4-triazol-3-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methanamine
CID 63313414

Frequently Asked Questions

What is the IUPAC name of [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine?
The IUPAC name of [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine (CID 79232663) is [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine is Cc1nnc(SCc2cccc(NN)n2)n1C.
What is the InChIKey of [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine?
The InChIKey is KTGLQFIYFLFUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6S/c1-7-14-15-10(16(7)2)17-6-8-4-3-5-9(12-8)13-11/h3-5H,6,11H2,1-2H3,(H,12,13).
What are the key properties of [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine?
[6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine has a molecular weight of 250.33 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 79232663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).