5-tert-butylpyridin-2-amine

C9H14N2 — CID 20587962

IUPAC5-tert-butylpyridin-2-amine
SMILESCC(C)(C)c1ccc(N)nc1
InChIInChI=1S/C9H14N2/c1-9(2,3)7-4-5-8(10)11-6-7/h4-6H,1-3H3,(H2,10,11)
InChIKeyMKEUSJZGHJDRHG-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.96
Rot. Bonds

About 5-tert-butylpyridin-2-amine

5-tert-butylpyridin-2-amine (PubChem CID 20587962) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 5-tert-butylpyridin-2-amine.

Molecular Properties

Compound Name5-tert-butylpyridin-2-amine
PubChem CID20587962
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name5-tert-butylpyridin-2-amine
SMILESCC(C)(C)c1ccc(N)nc1
InChIInChI=1S/C9H14N2/c1-9(2,3)7-4-5-8(10)11-6-7/h4-6H,1-3H3,(H2,10,11)
InChIKeyMKEUSJZGHJDRHG-UHFFFAOYSA-N
XLogP1.96
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butylpyridin-2-amine?
The IUPAC name of 5-tert-butylpyridin-2-amine (CID 20587962) is 5-tert-butylpyridin-2-amine.
What is the SMILES notation for 5-tert-butylpyridin-2-amine?
The canonical SMILES for 5-tert-butylpyridin-2-amine is CC(C)(C)c1ccc(N)nc1.
What is the InChIKey of 5-tert-butylpyridin-2-amine?
The InChIKey is MKEUSJZGHJDRHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-9(2,3)7-4-5-8(10)11-6-7/h4-6H,1-3H3,(H2,10,11).
What are the key properties of 5-tert-butylpyridin-2-amine?
5-tert-butylpyridin-2-amine has a molecular weight of 150.22 g/mol, XLogP of 1.96, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butylpyridin-2-amine is sourced from PubChem (CID 20587962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).