3-tert-butyl-N,5-dimethylpyridin-2-amine

C11H18N2 — CID 170078702

IUPAC3-tert-butyl-N,5-dimethylpyridin-2-amine
SMILESCNc1ncc(C)cc1C(C)(C)C
InChIInChI=1S/C11H18N2/c1-8-6-9(11(2,3)4)10(12-5)13-7-8/h6-7H,1-5H3,(H,12,13)
InChIKeyOSDXWBYTSZSQOZ-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.73
Rot. Bonds1

About 3-tert-butyl-N,5-dimethylpyridin-2-amine

3-tert-butyl-N,5-dimethylpyridin-2-amine (PubChem CID 170078702) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 3-tert-butyl-N,5-dimethylpyridin-2-amine.

Molecular Properties

Compound Name3-tert-butyl-N,5-dimethylpyridin-2-amine
PubChem CID170078702
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name3-tert-butyl-N,5-dimethylpyridin-2-amine
SMILESCNc1ncc(C)cc1C(C)(C)C
InChIInChI=1S/C11H18N2/c1-8-6-9(11(2,3)4)10(12-5)13-7-8/h6-7H,1-5H3,(H,12,13)
InChIKeyOSDXWBYTSZSQOZ-UHFFFAOYSA-N
XLogP2.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-N,5-dimethylpyridin-2-amine?
The IUPAC name of 3-tert-butyl-N,5-dimethylpyridin-2-amine (CID 170078702) is 3-tert-butyl-N,5-dimethylpyridin-2-amine.
What is the SMILES notation for 3-tert-butyl-N,5-dimethylpyridin-2-amine?
The canonical SMILES for 3-tert-butyl-N,5-dimethylpyridin-2-amine is CNc1ncc(C)cc1C(C)(C)C.
What is the InChIKey of 3-tert-butyl-N,5-dimethylpyridin-2-amine?
The InChIKey is OSDXWBYTSZSQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-8-6-9(11(2,3)4)10(12-5)13-7-8/h6-7H,1-5H3,(H,12,13).
What are the key properties of 3-tert-butyl-N,5-dimethylpyridin-2-amine?
3-tert-butyl-N,5-dimethylpyridin-2-amine has a molecular weight of 178.28 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-N,5-dimethylpyridin-2-amine is sourced from PubChem (CID 170078702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).