5-(4-tert-butylphenyl)pyridin-3-amine

C15H18N2 — CID 25184245

IUPAC5-(4-tert-butylphenyl)pyridin-3-amine
SMILESCC(C)(C)c1ccc(-c2cncc(N)c2)cc1
InChIInChI=1S/C15H18N2/c1-15(2,3)13-6-4-11(5-7-13)12-8-14(16)10-17-9-12/h4-10H,16H2,1-3H3
InChIKeyPDJKKBKBGOLIMU-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.63
Rot. Bonds1

About 5-(4-tert-butylphenyl)pyridin-3-amine

5-(4-tert-butylphenyl)pyridin-3-amine (PubChem CID 25184245) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 5-(4-tert-butylphenyl)pyridin-3-amine.

Molecular Properties

Compound Name5-(4-tert-butylphenyl)pyridin-3-amine
PubChem CID25184245
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name5-(4-tert-butylphenyl)pyridin-3-amine
SMILESCC(C)(C)c1ccc(-c2cncc(N)c2)cc1
InChIInChI=1S/C15H18N2/c1-15(2,3)13-6-4-11(5-7-13)12-8-14(16)10-17-9-12/h4-10H,16H2,1-3H3
InChIKeyPDJKKBKBGOLIMU-UHFFFAOYSA-N
XLogP3.63
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-tert-butylphenyl)pyridin-3-amine?
The IUPAC name of 5-(4-tert-butylphenyl)pyridin-3-amine (CID 25184245) is 5-(4-tert-butylphenyl)pyridin-3-amine.
What is the SMILES notation for 5-(4-tert-butylphenyl)pyridin-3-amine?
The canonical SMILES for 5-(4-tert-butylphenyl)pyridin-3-amine is CC(C)(C)c1ccc(-c2cncc(N)c2)cc1.
What is the InChIKey of 5-(4-tert-butylphenyl)pyridin-3-amine?
The InChIKey is PDJKKBKBGOLIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-15(2,3)13-6-4-11(5-7-13)12-8-14(16)10-17-9-12/h4-10H,16H2,1-3H3.
What are the key properties of 5-(4-tert-butylphenyl)pyridin-3-amine?
5-(4-tert-butylphenyl)pyridin-3-amine has a molecular weight of 226.32 g/mol, XLogP of 3.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-tert-butylphenyl)pyridin-3-amine is sourced from PubChem (CID 25184245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).