N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine

C19H20N2 — CID 58514141

IUPACN-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine
SMILESCC(C)(C)c1ccc2cc(Nc3ccccn3)ccc2c1
InChIInChI=1S/C19H20N2/c1-19(2,3)16-9-7-15-13-17(10-8-14(15)12-16)21-18-6-4-5-11-20-18/h4-13H,1-3H3,(H,20,21)
InChIKeyUHWXXRQMMYVXLG-UHFFFAOYSA-N
MW276.38 g/mol
LogP5.28
Rot. Bonds2

About N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine

N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine (PubChem CID 58514141) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine
PubChem CID58514141
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC NameN-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine
SMILESCC(C)(C)c1ccc2cc(Nc3ccccn3)ccc2c1
InChIInChI=1S/C19H20N2/c1-19(2,3)16-9-7-15-13-17(10-8-14(15)12-16)21-18-6-4-5-11-20-18/h4-13H,1-3H3,(H,20,21)
InChIKeyUHWXXRQMMYVXLG-UHFFFAOYSA-N
XLogP5.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.38
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine?
The IUPAC name of N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine (CID 58514141) is N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine.
What is the SMILES notation for N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine?
The canonical SMILES for N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine is CC(C)(C)c1ccc2cc(Nc3ccccn3)ccc2c1.
What is the InChIKey of N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine?
The InChIKey is UHWXXRQMMYVXLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-19(2,3)16-9-7-15-13-17(10-8-14(15)12-16)21-18-6-4-5-11-20-18/h4-13H,1-3H3,(H,20,21).
What are the key properties of N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine?
N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine has a molecular weight of 276.38 g/mol, XLogP of 5.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-tert-butylnaphthalen-2-yl)pyridin-2-amine is sourced from PubChem (CID 58514141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).