6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine

C13H8Cl2N4O — CID 67324626

IUPAC6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine
SMILESClc1ccc(Nc2cccc(-c3cnc(Cl)o3)n2)nc1
InChIInChI=1S/C13H8Cl2N4O/c14-8-4-5-11(16-6-8)19-12-3-1-2-9(18-12)10-7-17-13(15)20-10/h1-7H,(H,16,18,19)
InChIKeyGNQVCJQGIYEDDY-UHFFFAOYSA-N
MW307.14 g/mol
LogP4.18
Rot. Bonds3

About 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine

6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine (PubChem CID 67324626) has the molecular formula C13H8Cl2N4O and a molecular weight of 307.14 g/mol. Its IUPAC name is 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine
PubChem CID67324626
Molecular FormulaC13H8Cl2N4O
Molecular Weight307.14 g/mol
Exact Mass306.01
IUPAC Name6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine
SMILESClc1ccc(Nc2cccc(-c3cnc(Cl)o3)n2)nc1
InChIInChI=1S/C13H8Cl2N4O/c14-8-4-5-11(16-6-8)19-12-3-1-2-9(18-12)10-7-17-13(15)20-10/h1-7H,(H,16,18,19)
InChIKeyGNQVCJQGIYEDDY-UHFFFAOYSA-N
XLogP4.18
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.14
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine?
The IUPAC name of 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine (CID 67324626) is 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine.
What is the SMILES notation for 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine?
The canonical SMILES for 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine is Clc1ccc(Nc2cccc(-c3cnc(Cl)o3)n2)nc1.
What is the InChIKey of 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine?
The InChIKey is GNQVCJQGIYEDDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N4O/c14-8-4-5-11(16-6-8)19-12-3-1-2-9(18-12)10-7-17-13(15)20-10/h1-7H,(H,16,18,19).
What are the key properties of 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine?
6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine has a molecular weight of 307.14 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chloro-1,3-oxazol-5-yl)-N-(5-chloro-2-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 67324626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).