[2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine

C14H22N2 — CID 167291892

IUPAC[2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine
SMILESC/C=C\c1ccc(C)c(C(C)(C)C)c1NN
InChIInChI=1S/C14H22N2/c1-6-7-11-9-8-10(2)12(13(11)16-15)14(3,4)5/h6-9,16H,15H2,1-5H3/b7-6-
InChIKeyXBMGEIMOQIHICV-SREVYHEPSA-N
MW218.34 g/mol
LogP3.61
Rot. Bonds2

About [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine

[2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine (PubChem CID 167291892) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine.

Molecular Properties

Compound Name[2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine
PubChem CID167291892
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name[2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine
SMILESC/C=C\c1ccc(C)c(C(C)(C)C)c1NN
InChIInChI=1S/C14H22N2/c1-6-7-11-9-8-10(2)12(13(11)16-15)14(3,4)5/h6-9,16H,15H2,1-5H3/b7-6-
InChIKeyXBMGEIMOQIHICV-SREVYHEPSA-N
XLogP3.61
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine?
The IUPAC name of [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine (CID 167291892) is [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine.
What is the SMILES notation for [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine?
The canonical SMILES for [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine is C/C=C\c1ccc(C)c(C(C)(C)C)c1NN.
What is the InChIKey of [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine?
The InChIKey is XBMGEIMOQIHICV-SREVYHEPSA-N. The full InChI is InChI=1S/C14H22N2/c1-6-7-11-9-8-10(2)12(13(11)16-15)14(3,4)5/h6-9,16H,15H2,1-5H3/b7-6-.
What are the key properties of [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine?
[2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine has a molecular weight of 218.34 g/mol, XLogP of 3.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-tert-butyl-3-methyl-6-[(Z)-prop-1-enyl]phenyl]hydrazine is sourced from PubChem (CID 167291892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).