[(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine

C13H20N6 — CID 107504955

IUPAC[(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine
SMILESCCCn1nncc1C(NN)c1cc(C)nc(C)c1
InChIInChI=1S/C13H20N6/c1-4-5-19-12(8-15-18-19)13(17-14)11-6-9(2)16-10(3)7-11/h6-8,13,17H,4-5,14H2,1-3H3
InChIKeyUXUJCKOPZFTPNB-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.25
Rot. Bonds5

About [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine

[(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine (PubChem CID 107504955) has the molecular formula C13H20N6 and a molecular weight of 260.34 g/mol. Its IUPAC name is [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine
PubChem CID107504955
Molecular FormulaC13H20N6
Molecular Weight260.34 g/mol
Exact Mass260.17
IUPAC Name[(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine
SMILESCCCn1nncc1C(NN)c1cc(C)nc(C)c1
InChIInChI=1S/C13H20N6/c1-4-5-19-12(8-15-18-19)13(17-14)11-6-9(2)16-10(3)7-11/h6-8,13,17H,4-5,14H2,1-3H3
InChIKeyUXUJCKOPZFTPNB-UHFFFAOYSA-N
XLogP1.25
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

[(3-bromo-5-fluorophenyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105238620
[(4-bromophenyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105192382
[(5-methylpyrimidin-2-yl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105261508
[(6-chloro-3-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105253024
[(2-chloro-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105252709
[(4-bromo-3-fluorophenyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105335616
N-[(3,5-dimethylphenyl)-(3-propyltriazol-4-yl)methyl]ethanamine
CID 105038920
[(3-ethyl-1-methylpyrazol-5-yl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105335521
[(1-methylimidazol-4-yl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 107979405
1-(3-fluoro-5-methylphenyl)-N-methyl-1-(3-propyltriazol-4-yl)methanamine
CID 114688825
[(4-propylthiadiazol-5-yl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105335545
1-(3-bromo-5-methylphenyl)-N-methyl-1-(3-propyltriazol-4-yl)methanamine
CID 105038575

Frequently Asked Questions

What is the IUPAC name of [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine?
The IUPAC name of [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine (CID 107504955) is [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine is CCCn1nncc1C(NN)c1cc(C)nc(C)c1.
What is the InChIKey of [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine?
The InChIKey is UXUJCKOPZFTPNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6/c1-4-5-19-12(8-15-18-19)13(17-14)11-6-9(2)16-10(3)7-11/h6-8,13,17H,4-5,14H2,1-3H3.
What are the key properties of [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine?
[(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine has a molecular weight of 260.34 g/mol, XLogP of 1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,6-dimethyl-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 107504955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).