6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol

C15H26N2O — CID 57063776

IUPAC6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol
SMILESCc1c(CNN(C)C)cc(C(C)(C)C)c(O)c1C
InChIInChI=1S/C15H26N2O/c1-10-11(2)14(18)13(15(3,4)5)8-12(10)9-16-17(6)7/h8,16,18H,9H2,1-7H3
InChIKeyBTFWIARZDPLKRH-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.87
Rot. Bonds3

About 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol

6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol (PubChem CID 57063776) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol.

Molecular Properties

Compound Name6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol
PubChem CID57063776
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol
SMILESCc1c(CNN(C)C)cc(C(C)(C)C)c(O)c1C
InChIInChI=1S/C15H26N2O/c1-10-11(2)14(18)13(15(3,4)5)8-12(10)9-16-17(6)7/h8,16,18H,9H2,1-7H3
InChIKeyBTFWIARZDPLKRH-UHFFFAOYSA-N
XLogP2.87
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-tert-butyl-4-[(dimethylamino)methyl]-2,3-dimethylphenol
CID 22101590
(5-tert-butyl-4-hydroxy-2,3-dimethylphenyl)methylphosphonic acid
CID 22101595
3-(5-tert-butyl-4-hydroxy-2,3-dimethylphenyl)-N-methyl-N-tetracosylpropanamide
CID 54302474
6-tert-butyl-2,4-dimethyl-3-(methylaminomethyl)phenol
CID 20574810
4,6-ditert-butyl-2-(3,5-ditert-butyl-2-hydroxy-6-methylphenyl)-3-methylphenol
CID 11236289
N,N,N',N'-tetrakis(3,5-ditert-butyl-4-hydroxyphenyl)oxamide
CID 71325318
3-tert-butyl-2-hydroxy-6-methyl-5-(2-methylpentan-2-yl)benzoic acid
CID 19822805
2-(3-tert-butyl-2-hydroxy-5-methylphenyl)acetohydrazide
CID 87214855
6-tert-butyl-3-methyl-2,4-dioctylphenol
CID 139902763
6-tert-butyl-2,3,4-trimethylphenol;2,6-ditert-butyl-4-methylphenol;methane
CID 159742273
propyl 2-(5-tert-butyl-4-hydroxy-2,3-dimethylphenyl)propanoate
CID 139652187
4-[[[4-[bis[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]amino]-6-[(3,5-ditert-butyl-4-hydroxyphenyl)methylamino]-1,3,5-triazin-2-yl]amino]methyl]-2,6-ditert-butyl-3-methylphenol
CID 146531019

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol?
The IUPAC name of 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol (CID 57063776) is 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol.
What is the SMILES notation for 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol?
The canonical SMILES for 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol is Cc1c(CNN(C)C)cc(C(C)(C)C)c(O)c1C.
What is the InChIKey of 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol?
The InChIKey is BTFWIARZDPLKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-10-11(2)14(18)13(15(3,4)5)8-12(10)9-16-17(6)7/h8,16,18H,9H2,1-7H3.
What are the key properties of 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol?
6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol has a molecular weight of 250.39 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-4-[(2,2-dimethylhydrazinyl)methyl]-2,3-dimethylphenol is sourced from PubChem (CID 57063776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).