1-(3-methyltriazol-4-yl)dodecylhydrazine

C15H31N5 — CID 105337498

IUPAC1-(3-methyltriazol-4-yl)dodecylhydrazine
SMILESCCCCCCCCCCCC(NN)c1cnnn1C
InChIInChI=1S/C15H31N5/c1-3-4-5-6-7-8-9-10-11-12-14(18-16)15-13-17-19-20(15)2/h13-14,18H,3-12,16H2,1-2H3
InChIKeyNPNKMHLBBBWCKC-UHFFFAOYSA-N
MW281.45 g/mol
LogP3.24
Rot. Bonds12

About 1-(3-methyltriazol-4-yl)dodecylhydrazine

1-(3-methyltriazol-4-yl)dodecylhydrazine (PubChem CID 105337498) has the molecular formula C15H31N5 and a molecular weight of 281.45 g/mol. Its IUPAC name is 1-(3-methyltriazol-4-yl)dodecylhydrazine.

Molecular Properties

Compound Name1-(3-methyltriazol-4-yl)dodecylhydrazine
PubChem CID105337498
Molecular FormulaC15H31N5
Molecular Weight281.45 g/mol
Exact Mass281.26
IUPAC Name1-(3-methyltriazol-4-yl)dodecylhydrazine
SMILESCCCCCCCCCCCC(NN)c1cnnn1C
InChIInChI=1S/C15H31N5/c1-3-4-5-6-7-8-9-10-11-12-14(18-16)15-13-17-19-20(15)2/h13-14,18H,3-12,16H2,1-2H3
InChIKeyNPNKMHLBBBWCKC-UHFFFAOYSA-N
XLogP3.24
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.45
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-(3-methyltriazol-4-yl)hexylhydrazine
CID 105337497
1-(3-methyltriazol-4-yl)-N-propylheptan-1-amine
CID 105043647
1-(3-phenyltriazol-4-yl)heptylhydrazine
CID 105337463
1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine
CID 105293484
1-(2-methylpyrazol-3-yl)dodecylhydrazine
CID 105307363
1-(2,5-dimethylpyrazol-3-yl)octylhydrazine
CID 105293599
[1-(3-methyltriazol-4-yl)-4-thiophen-2-ylbutyl]hydrazine
CID 105337635
[3,3-dimethyl-1-(3-methyltriazol-4-yl)butyl]hydrazine
CID 105220254
1-(3-methyltriazol-4-yl)-N-propylbutan-1-amine
CID 114687206
1-(3-methylimidazol-4-yl)pentylhydrazine
CID 105264511
1-(1,3-dimethylpyrazol-4-yl)decylhydrazine
CID 102804828
1-(1-methylpyrazol-4-yl)hexylhydrazine
CID 105228484

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyltriazol-4-yl)dodecylhydrazine?
The IUPAC name of 1-(3-methyltriazol-4-yl)dodecylhydrazine (CID 105337498) is 1-(3-methyltriazol-4-yl)dodecylhydrazine.
What is the SMILES notation for 1-(3-methyltriazol-4-yl)dodecylhydrazine?
The canonical SMILES for 1-(3-methyltriazol-4-yl)dodecylhydrazine is CCCCCCCCCCCC(NN)c1cnnn1C.
What is the InChIKey of 1-(3-methyltriazol-4-yl)dodecylhydrazine?
The InChIKey is NPNKMHLBBBWCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N5/c1-3-4-5-6-7-8-9-10-11-12-14(18-16)15-13-17-19-20(15)2/h13-14,18H,3-12,16H2,1-2H3.
What are the key properties of 1-(3-methyltriazol-4-yl)dodecylhydrazine?
1-(3-methyltriazol-4-yl)dodecylhydrazine has a molecular weight of 281.45 g/mol, XLogP of 3.24, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyltriazol-4-yl)dodecylhydrazine is sourced from PubChem (CID 105337498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).