2,4-ditert-butyl-6-(dimethylamino)phenol

C16H27NO — CID 14270373

IUPAC2,4-ditert-butyl-6-(dimethylamino)phenol
SMILESCN(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1O
InChIInChI=1S/C16H27NO/c1-15(2,3)11-9-12(16(4,5)6)14(18)13(10-11)17(7)8/h9-10,18H,1-8H3
InChIKeyXZFBFWBVNSIGLQ-UHFFFAOYSA-N
MW249.40 g/mol
LogP4.05
Rot. Bonds1

About 2,4-ditert-butyl-6-(dimethylamino)phenol

2,4-ditert-butyl-6-(dimethylamino)phenol (PubChem CID 14270373) has the molecular formula C16H27NO and a molecular weight of 249.40 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-(dimethylamino)phenol.

Molecular Properties

Compound Name2,4-ditert-butyl-6-(dimethylamino)phenol
PubChem CID14270373
Molecular FormulaC16H27NO
Molecular Weight249.40 g/mol
Exact Mass249.21
IUPAC Name2,4-ditert-butyl-6-(dimethylamino)phenol
SMILESCN(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1O
InChIInChI=1S/C16H27NO/c1-15(2,3)11-9-12(16(4,5)6)14(18)13(10-11)17(7)8/h9-10,18H,1-8H3
InChIKeyXZFBFWBVNSIGLQ-UHFFFAOYSA-N
XLogP4.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-ditert-butyl-6-(diethylamino)phenol
CID 90717515
2-[N-(2-aminoethyl)-3,5-ditert-butyl-2-hydroxyanilino]-4,6-ditert-butylphenol
CID 70700395
2,4-ditert-butyl-6-(3,5-ditert-butyl-2-hydroxy-N-propylanilino)phenol
CID 102041593
2,4-ditert-butyl-6-[3,5-ditert-butyl-2-hydroxy-N-(2-methoxyethyl)anilino]phenol
CID 102041591
CID 135046337
CID 135046337
2-[[4-[bis(3,5-ditert-butyl-2-hydroxyphenyl)methyl]phenyl]-(3,5-ditert-butyl-2-hydroxyphenyl)methyl]-4,6-ditert-butylphenol
CID 102598730
CID 158661910
CID 158661910
2,4-ditert-butyl-6-(methylamino)phenol
CID 57470249
2-[[bis[3-(dimethylamino)propyl]amino]methyl]-4,6-ditert-butylphenol
CID 30981664
2-(aminomethyl)-4,6-ditert-butylphenol
CID 12652148
bis(copper(1+));bis(2,4-ditert-butyl-6-(3,5-ditert-butyl-2-hydroxyphenyl)sulfanylphenol);dichloride
CID 10898436
2,4-ditert-butyl-6-(3,5-ditert-butyl-2-hydroxyphenyl)sulfinylphenol
CID 10790081

Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-6-(dimethylamino)phenol?
The IUPAC name of 2,4-ditert-butyl-6-(dimethylamino)phenol (CID 14270373) is 2,4-ditert-butyl-6-(dimethylamino)phenol.
What is the SMILES notation for 2,4-ditert-butyl-6-(dimethylamino)phenol?
The canonical SMILES for 2,4-ditert-butyl-6-(dimethylamino)phenol is CN(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1O.
What is the InChIKey of 2,4-ditert-butyl-6-(dimethylamino)phenol?
The InChIKey is XZFBFWBVNSIGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO/c1-15(2,3)11-9-12(16(4,5)6)14(18)13(10-11)17(7)8/h9-10,18H,1-8H3.
What are the key properties of 2,4-ditert-butyl-6-(dimethylamino)phenol?
2,4-ditert-butyl-6-(dimethylamino)phenol has a molecular weight of 249.40 g/mol, XLogP of 4.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-ditert-butyl-6-(dimethylamino)phenol is sourced from PubChem (CID 14270373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).