1-(3-phenyltriazol-4-yl)heptylhydrazine

C15H23N5 — CID 105337463

IUPAC1-(3-phenyltriazol-4-yl)heptylhydrazine
SMILESCCCCCCC(NN)c1cnnn1-c1ccccc1
InChIInChI=1S/C15H23N5/c1-2-3-4-8-11-14(18-16)15-12-17-19-20(15)13-9-6-5-7-10-13/h5-7,9-10,12,14,18H,2-4,8,11,16H2,1H3
InChIKeyUTEHZUSLWSMRHO-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.74
Rot. Bonds8

About 1-(3-phenyltriazol-4-yl)heptylhydrazine

1-(3-phenyltriazol-4-yl)heptylhydrazine (PubChem CID 105337463) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 1-(3-phenyltriazol-4-yl)heptylhydrazine.

Molecular Properties

Compound Name1-(3-phenyltriazol-4-yl)heptylhydrazine
PubChem CID105337463
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name1-(3-phenyltriazol-4-yl)heptylhydrazine
SMILESCCCCCCC(NN)c1cnnn1-c1ccccc1
InChIInChI=1S/C15H23N5/c1-2-3-4-8-11-14(18-16)15-12-17-19-20(15)13-9-6-5-7-10-13/h5-7,9-10,12,14,18H,2-4,8,11,16H2,1H3
InChIKeyUTEHZUSLWSMRHO-UHFFFAOYSA-N
XLogP2.74
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.74
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-phenyltriazol-4-yl)butylhydrazine
CID 105202328
1-(3-methyltriazol-4-yl)dodecylhydrazine
CID 105337498
1-(3-methyltriazol-4-yl)hexylhydrazine
CID 105337497
[2-butan-2-ylsulfanyl-1-(3-phenyltriazol-4-yl)ethyl]hydrazine
CID 105227341
N-ethyl-1-(3-phenyltriazol-4-yl)butan-1-amine
CID 114687204
[(1S)-1-phenyldecyl]hydrazine
CID 124596381
1-pyrazolo[1,5-a]pyridin-3-ylhexylhydrazine
CID 103129533
[1-(3-phenyltriazol-4-yl)-2-pyridin-2-ylethyl]hydrazine
CID 105200047
N-methyl-1-(3-phenyltriazol-4-yl)-3-propoxypropan-1-amine
CID 105184360
2-(1-hydrazinylheptyl)phenol
CID 155127911
1-(2-methylpyrazol-3-yl)dodecylhydrazine
CID 105307363
N-ethyl-3,3-dimethyl-1-(3-phenyltriazol-4-yl)butan-1-amine
CID 114687752

Frequently Asked Questions

What is the IUPAC name of 1-(3-phenyltriazol-4-yl)heptylhydrazine?
The IUPAC name of 1-(3-phenyltriazol-4-yl)heptylhydrazine (CID 105337463) is 1-(3-phenyltriazol-4-yl)heptylhydrazine.
What is the SMILES notation for 1-(3-phenyltriazol-4-yl)heptylhydrazine?
The canonical SMILES for 1-(3-phenyltriazol-4-yl)heptylhydrazine is CCCCCCC(NN)c1cnnn1-c1ccccc1.
What is the InChIKey of 1-(3-phenyltriazol-4-yl)heptylhydrazine?
The InChIKey is UTEHZUSLWSMRHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-2-3-4-8-11-14(18-16)15-12-17-19-20(15)13-9-6-5-7-10-13/h5-7,9-10,12,14,18H,2-4,8,11,16H2,1H3.
What are the key properties of 1-(3-phenyltriazol-4-yl)heptylhydrazine?
1-(3-phenyltriazol-4-yl)heptylhydrazine has a molecular weight of 273.38 g/mol, XLogP of 2.74, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-phenyltriazol-4-yl)heptylhydrazine is sourced from PubChem (CID 105337463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).