[3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine

C14H21N5 — CID 105298472

IUPAC[3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine
SMILESCCC(C)CC(NN)c1cnn(-c2ccccc2)n1
InChIInChI=1S/C14H21N5/c1-3-11(2)9-13(17-15)14-10-16-19(18-14)12-7-5-4-6-8-12/h4-8,10-11,13,17H,3,9,15H2,1-2H3
InChIKeyZOAUBKFJLWYXNF-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.21
Rot. Bonds6

About [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine

[3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine (PubChem CID 105298472) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine.

Molecular Properties

Compound Name[3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine
PubChem CID105298472
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name[3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine
SMILESCCC(C)CC(NN)c1cnn(-c2ccccc2)n1
InChIInChI=1S/C14H21N5/c1-3-11(2)9-13(17-15)14-10-16-19(18-14)12-7-5-4-6-8-12/h4-8,10-11,13,17H,3,9,15H2,1-2H3
InChIKeyZOAUBKFJLWYXNF-UHFFFAOYSA-N
XLogP2.21
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
CID 105291066
[2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
CID 107066810
N,5-dimethyl-1-(2-phenyltriazol-4-yl)hexan-1-amine
CID 105177169
4-pentan-2-yl-2-phenyltriazole
CID 163429787
N,4-dimethyl-1-(2-phenyltriazol-4-yl)pent-4-en-1-amine
CID 105182681
[(2-phenyltriazol-4-yl)-pyrimidin-5-ylmethyl]hydrazine
CID 105292082
N-ethyl-3-methylidene-1-(2-phenyltriazol-4-yl)pentan-1-amine
CID 105163963
2-methyl-1-(2-phenyltriazol-4-yl)pentan-1-ol
CID 114013665
(3-methyl-1-pyrazolo[1,5-a]pyridin-3-ylpentyl)hydrazine
CID 103129571
[3-methyl-1-(4-phenylphenyl)pentyl]hydrazine
CID 105310511
N-ethyl-1-(2-phenyltriazol-4-yl)hex-5-en-1-amine
CID 105153106
4,4-dimethyl-1-(2-phenyltriazol-4-yl)pentan-1-ol
CID 105091547

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine?
The IUPAC name of [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine (CID 105298472) is [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine.
What is the SMILES notation for [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine?
The canonical SMILES for [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine is CCC(C)CC(NN)c1cnn(-c2ccccc2)n1.
What is the InChIKey of [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine?
The InChIKey is ZOAUBKFJLWYXNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-3-11(2)9-13(17-15)14-10-16-19(18-14)12-7-5-4-6-8-12/h4-8,10-11,13,17H,3,9,15H2,1-2H3.
What are the key properties of [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine?
[3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine has a molecular weight of 259.36 g/mol, XLogP of 2.21, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine is sourced from PubChem (CID 105298472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).