[1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine

C15H29N5 — CID 107066160

IUPAC[1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine
SMILESCn1cc(CC(NN)C2CCC(C(C)(C)C)CC2)nn1
InChIInChI=1S/C15H29N5/c1-15(2,3)12-7-5-11(6-8-12)14(17-16)9-13-10-20(4)19-18-13/h10-12,14,17H,5-9,16H2,1-4H3
InChIKeyPYTYDXOFWXTRNV-UHFFFAOYSA-N
MW279.43 g/mol
LogP2.04
Rot. Bonds4

About [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine

[1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine (PubChem CID 107066160) has the molecular formula C15H29N5 and a molecular weight of 279.43 g/mol. Its IUPAC name is [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine
PubChem CID107066160
Molecular FormulaC15H29N5
Molecular Weight279.43 g/mol
Exact Mass279.24
IUPAC Name[1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine
SMILESCn1cc(CC(NN)C2CCC(C(C)(C)C)CC2)nn1
InChIInChI=1S/C15H29N5/c1-15(2,3)12-7-5-11(6-8-12)14(17-16)9-13-10-20(4)19-18-13/h10-12,14,17H,5-9,16H2,1-4H3
InChIKeyPYTYDXOFWXTRNV-UHFFFAOYSA-N
XLogP2.04
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 52.04
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

[1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine
CID 107066631
1-cyclopropyl-N-methyl-3-(1-methyltriazol-4-yl)propan-1-amine
CID 107044720
1-(4,4-dimethylcyclohexyl)-N-ethyl-2-(1-methyltriazol-4-yl)ethanamine
CID 107049504
[1-(4-tert-butylcyclohexyl)-3-methylbutyl]hydrazine
CID 105232627
1-(3-bicyclo[3.1.0]hexanyl)-N-methyl-2-(1-methyltriazol-4-yl)ethanamine
CID 107064608
1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-2-(1-methyltriazol-4-yl)ethanamine
CID 107064594
1-(4-tert-butylcyclohexyl)-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 65403165
[1-(4-tert-butylcyclohexyl)-2-(2-chlorophenyl)ethyl]hydrazine
CID 105232724
1-(4-ethylcyclohexyl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107049489
2-cyclopropyl-1-(1-methyltriazol-4-yl)propan-2-ol
CID 107045723
N-ethyl-2-(1-methyltriazol-4-yl)-1-[3-(trifluoromethyl)cyclohexyl]ethanamine
CID 107063738
1-(4-methylcyclohexyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107046119

Frequently Asked Questions

What is the IUPAC name of [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine (CID 107066160) is [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine is Cn1cc(CC(NN)C2CCC(C(C)(C)C)CC2)nn1.
What is the InChIKey of [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine?
The InChIKey is PYTYDXOFWXTRNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5/c1-15(2,3)12-7-5-11(6-8-12)14(17-16)9-13-10-20(4)19-18-13/h10-12,14,17H,5-9,16H2,1-4H3.
What are the key properties of [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine?
[1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine has a molecular weight of 279.43 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 107066160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).