1,1-bis(3,5-ditert-butylphenyl)hydrazine

C28H44N2 — CID 637636

IUPAC1,1-bis(3,5-ditert-butylphenyl)hydrazine
SMILESCC(C)(C)c1cc(N(N)c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1
InChIInChI=1S/C28H44N2/c1-25(2,3)19-13-20(26(4,5)6)16-23(15-19)30(29)24-17-21(27(7,8)9)14-22(18-24)28(10,11)12/h13-18H,29H2,1-12H3
InChIKeyCEIJHLXVCIMKHV-UHFFFAOYSA-N
MW408.67 g/mol
LogP7.89
Rot. Bonds2

About 1,1-bis(3,5-ditert-butylphenyl)hydrazine

1,1-bis(3,5-ditert-butylphenyl)hydrazine (PubChem CID 637636) has the molecular formula C28H44N2 and a molecular weight of 408.67 g/mol. Its IUPAC name is 1,1-bis(3,5-ditert-butylphenyl)hydrazine.

Molecular Properties

Compound Name1,1-bis(3,5-ditert-butylphenyl)hydrazine
PubChem CID637636
Molecular FormulaC28H44N2
Molecular Weight408.67 g/mol
Exact Mass408.35
IUPAC Name1,1-bis(3,5-ditert-butylphenyl)hydrazine
SMILESCC(C)(C)c1cc(N(N)c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1
InChIInChI=1S/C28H44N2/c1-25(2,3)19-13-20(26(4,5)6)16-23(15-19)30(29)24-17-21(27(7,8)9)14-22(18-24)28(10,11)12/h13-18H,29H2,1-12H3
InChIKeyCEIJHLXVCIMKHV-UHFFFAOYSA-N
XLogP7.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.67
LogP ≤ 57.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,1-bis(3,5-ditert-butylphenyl)hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,4'-Bis(1,1,3,3-tetramethylbutyl)diphenylamine
CID 85069
Benzenamine, ar-nonyl-N-(nonylphenyl)-
CID 22168299
Di-3,5-xylylamine
CID 138473
N,N-Di(p-tolyl)hydrazine
CID 154888
3,3'-Dioctyldiphenylamine
CID 21536883
1-(3,5-Dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine
CID 162401436
3,5-ditert-butyl-N-(3,5-ditert-butylphenyl)aniline
CID 4141600
1,2-Bis(3,5-di-tert-butylphenyl)diazene
CID 12743687
N-(4-tolyl)-N-phenyl-hydrazine
CID 13468025
4,4'-Di-t-octyldiphenylamine
CID 15919999
3-dimethylbutyl-N-phenyl-p-phenylenediamine
CID 67247581
(2,4,6-Tri-t-butylphenyl)aminyl benzene
CID 129657954

Frequently Asked Questions

What is the IUPAC name of 1,1-bis(3,5-ditert-butylphenyl)hydrazine?
The IUPAC name of 1,1-bis(3,5-ditert-butylphenyl)hydrazine (CID 637636) is 1,1-bis(3,5-ditert-butylphenyl)hydrazine.
What is the SMILES notation for 1,1-bis(3,5-ditert-butylphenyl)hydrazine?
The canonical SMILES for 1,1-bis(3,5-ditert-butylphenyl)hydrazine is CC(C)(C)c1cc(N(N)c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1.
What is the InChIKey of 1,1-bis(3,5-ditert-butylphenyl)hydrazine?
The InChIKey is CEIJHLXVCIMKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H44N2/c1-25(2,3)19-13-20(26(4,5)6)16-23(15-19)30(29)24-17-21(27(7,8)9)14-22(18-24)28(10,11)12/h13-18H,29H2,1-12H3.
What are the key properties of 1,1-bis(3,5-ditert-butylphenyl)hydrazine?
1,1-bis(3,5-ditert-butylphenyl)hydrazine has a molecular weight of 408.67 g/mol, XLogP of 7.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(3,5-ditert-butylphenyl)hydrazine is sourced from PubChem (CID 637636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).