N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine

C13H22N2 — CID 176658532

IUPACN-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine
SMILESCC(C)c1cccc(NCC(C)(C)C)n1
InChIInChI=1S/C13H22N2/c1-10(2)11-7-6-8-12(15-11)14-9-13(3,4)5/h6-8,10H,9H2,1-5H3,(H,14,15)
InChIKeyIVDZYTYZBLPING-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.66
Rot. Bonds3

About N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine

N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine (PubChem CID 176658532) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine
PubChem CID176658532
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC NameN-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine
SMILESCC(C)c1cccc(NCC(C)(C)C)n1
InChIInChI=1S/C13H22N2/c1-10(2)11-7-6-8-12(15-11)14-9-13(3,4)5/h6-8,10H,9H2,1-5H3,(H,14,15)
InChIKeyIVDZYTYZBLPING-UHFFFAOYSA-N
XLogP3.66
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine?
The IUPAC name of N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine (CID 176658532) is N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine.
What is the SMILES notation for N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine?
The canonical SMILES for N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine is CC(C)c1cccc(NCC(C)(C)C)n1.
What is the InChIKey of N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine?
The InChIKey is IVDZYTYZBLPING-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-10(2)11-7-6-8-12(15-11)14-9-13(3,4)5/h6-8,10H,9H2,1-5H3,(H,14,15).
What are the key properties of N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine?
N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine has a molecular weight of 206.33 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-6-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 176658532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).