[cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine

C9H17N5 — CID 130899454

IUPAC[cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine
SMILESCc1nnc(C(NN)C2CCC2)n1C
InChIInChI=1S/C9H17N5/c1-6-12-13-9(14(6)2)8(11-10)7-4-3-5-7/h7-8,11H,3-5,10H2,1-2H3
InChIKeyYXAXSOUVKXZDAH-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.43
Rot. Bonds3

About [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine

[cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine (PubChem CID 130899454) has the molecular formula C9H17N5 and a molecular weight of 195.27 g/mol. Its IUPAC name is [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine
PubChem CID130899454
Molecular FormulaC9H17N5
Molecular Weight195.27 g/mol
Exact Mass195.15
IUPAC Name[cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine
SMILESCc1nnc(C(NN)C2CCC2)n1C
InChIInChI=1S/C9H17N5/c1-6-12-13-9(14(6)2)8(11-10)7-4-3-5-7/h7-8,11H,3-5,10H2,1-2H3
InChIKeyYXAXSOUVKXZDAH-UHFFFAOYSA-N
XLogP0.43
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.43
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

[cyclobutyl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine
CID 105340101
[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105340044
[cyclobutyl-(2,6-dimethyl-3-pyridinyl)methyl]hydrazine
CID 105340078
3-(1-chloroethyl)-4,5-dimethyl-1,2,4-triazole
CID 23462388
[(5-bromo-3-methyltriazol-4-yl)-cyclooctylmethyl]hydrazine
CID 106466142
[cyclobutyl-(5-iodo-1-methylpyrazol-4-yl)methyl]hydrazine
CID 131107647
[cyclopentyl-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105204250
[cyclopropyl-(6-methylpyridazin-3-yl)methyl]hydrazine
CID 127017379
[cyclooctyl-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105255052
(4,5-dimethyl-1,2,4-triazol-3-yl)-(thiolan-2-yl)methanol
CID 130942785
[cyclobutyl-(3-methyl-2-pyridinyl)methyl]hydrazine
CID 105209352
[cyclobutyl-(4-methylthiophen-2-yl)methyl]hydrazine
CID 131160598

Frequently Asked Questions

What is the IUPAC name of [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine?
The IUPAC name of [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine (CID 130899454) is [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine.
What is the SMILES notation for [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine?
The canonical SMILES for [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine is Cc1nnc(C(NN)C2CCC2)n1C.
What is the InChIKey of [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine?
The InChIKey is YXAXSOUVKXZDAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5/c1-6-12-13-9(14(6)2)8(11-10)7-4-3-5-7/h7-8,11H,3-5,10H2,1-2H3.
What are the key properties of [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine?
[cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine has a molecular weight of 195.27 g/mol, XLogP of 0.43, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclobutyl-(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]hydrazine is sourced from PubChem (CID 130899454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).