4,6-ditert-butylpyridin-2-amine

C13H22N2 — CID 166788497

IUPAC4,6-ditert-butylpyridin-2-amine
SMILESCC(C)(C)c1cc(N)nc(C(C)(C)C)c1
InChIInChI=1S/C13H22N2/c1-12(2,3)9-7-10(13(4,5)6)15-11(14)8-9/h7-8H,1-6H3,(H2,14,15)
InChIKeyVGZWTINKVJABCL-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.26
Rot. Bonds

About 4,6-ditert-butylpyridin-2-amine

4,6-ditert-butylpyridin-2-amine (PubChem CID 166788497) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 4,6-ditert-butylpyridin-2-amine.

Molecular Properties

Compound Name4,6-ditert-butylpyridin-2-amine
PubChem CID166788497
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name4,6-ditert-butylpyridin-2-amine
SMILESCC(C)(C)c1cc(N)nc(C(C)(C)C)c1
InChIInChI=1S/C13H22N2/c1-12(2,3)9-7-10(13(4,5)6)15-11(14)8-9/h7-8H,1-6H3,(H2,14,15)
InChIKeyVGZWTINKVJABCL-UHFFFAOYSA-N
XLogP3.26
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,6-ditert-butylpyridin-2-amine?
The IUPAC name of 4,6-ditert-butylpyridin-2-amine (CID 166788497) is 4,6-ditert-butylpyridin-2-amine.
What is the SMILES notation for 4,6-ditert-butylpyridin-2-amine?
The canonical SMILES for 4,6-ditert-butylpyridin-2-amine is CC(C)(C)c1cc(N)nc(C(C)(C)C)c1.
What is the InChIKey of 4,6-ditert-butylpyridin-2-amine?
The InChIKey is VGZWTINKVJABCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-12(2,3)9-7-10(13(4,5)6)15-11(14)8-9/h7-8H,1-6H3,(H2,14,15).
What are the key properties of 4,6-ditert-butylpyridin-2-amine?
4,6-ditert-butylpyridin-2-amine has a molecular weight of 206.33 g/mol, XLogP of 3.26, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-ditert-butylpyridin-2-amine is sourced from PubChem (CID 166788497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).