[(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine

C17H30N4 — CID 105247429

IUPAC[(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine
SMILESCN1CCN(C)C(C(NN)c2ccc(C(C)(C)C)cc2)C1
InChIInChI=1S/C17H30N4/c1-17(2,3)14-8-6-13(7-9-14)16(19-18)15-12-20(4)10-11-21(15)5/h6-9,15-16,19H,10-12,18H2,1-5H3
InChIKeyQKXRFKWZBVIMND-UHFFFAOYSA-N
MW290.46 g/mol
LogP1.73
Rot. Bonds3

About [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine

[(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine (PubChem CID 105247429) has the molecular formula C17H30N4 and a molecular weight of 290.46 g/mol. Its IUPAC name is [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine
PubChem CID105247429
Molecular FormulaC17H30N4
Molecular Weight290.46 g/mol
Exact Mass290.25
IUPAC Name[(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine
SMILESCN1CCN(C)C(C(NN)c2ccc(C(C)(C)C)cc2)C1
InChIInChI=1S/C17H30N4/c1-17(2,3)14-8-6-13(7-9-14)16(19-18)15-12-20(4)10-11-21(15)5/h6-9,15-16,19H,10-12,18H2,1-5H3
InChIKeyQKXRFKWZBVIMND-UHFFFAOYSA-N
XLogP1.73
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.46
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[(1,4-dimethylpiperazin-2-yl)-(4-methylphenyl)methyl]hydrazine
CID 105247203
[(1,4-dimethylpiperazin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105247407
[(1,4-dimethyl-1,4-diazepan-2-yl)-(4-fluorophenyl)methyl]hydrazine
CID 105261273
[(4-chlorophenyl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261246
[(1,4-dimethyl-1,4-diazepan-2-yl)-(4-propylphenyl)methyl]hydrazine
CID 105261179
[(1,4-dimethylpiperazin-2-yl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105247363
[(1,4-dimethyl-1,4-diazepan-2-yl)-pyrimidin-5-ylmethyl]hydrazine
CID 105261200
[(1,4-dimethylpiperazin-2-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 105247174
[(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105261282
[(4-tert-butylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105231567
(4-chlorophenyl)-(1,4-dimethylpiperazin-2-yl)methanamine
CID 79658672
[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105261259

Frequently Asked Questions

What is the IUPAC name of [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine?
The IUPAC name of [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine (CID 105247429) is [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine is CN1CCN(C)C(C(NN)c2ccc(C(C)(C)C)cc2)C1.
What is the InChIKey of [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine?
The InChIKey is QKXRFKWZBVIMND-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-17(2,3)14-8-6-13(7-9-14)16(19-18)15-12-20(4)10-11-21(15)5/h6-9,15-16,19H,10-12,18H2,1-5H3.
What are the key properties of [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine?
[(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine has a molecular weight of 290.46 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine is sourced from PubChem (CID 105247429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).