5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine

C11H16BrN3O — CID 23438259

IUPAC5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine
SMILESBrc1ccc(NCCN2CCOCC2)nc1
InChIInChI=1S/C11H16BrN3O/c12-10-1-2-11(14-9-10)13-3-4-15-5-7-16-8-6-15/h1-2,9H,3-8H2,(H,13,14)
InChIKeyOBYPVXGEXMMHLO-UHFFFAOYSA-N
MW286.17 g/mol
LogP1.59
Rot. Bonds4

About 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine

5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine (PubChem CID 23438259) has the molecular formula C11H16BrN3O and a molecular weight of 286.17 g/mol. Its IUPAC name is 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine
PubChem CID23438259
Molecular FormulaC11H16BrN3O
Molecular Weight286.17 g/mol
Exact Mass285.05
IUPAC Name5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine
SMILESBrc1ccc(NCCN2CCOCC2)nc1
InChIInChI=1S/C11H16BrN3O/c12-10-1-2-11(14-9-10)13-3-4-15-5-7-16-8-6-15/h1-2,9H,3-8H2,(H,13,14)
InChIKeyOBYPVXGEXMMHLO-UHFFFAOYSA-N
XLogP1.59
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.17
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine?
The IUPAC name of 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine (CID 23438259) is 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine is Brc1ccc(NCCN2CCOCC2)nc1.
What is the InChIKey of 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine?
The InChIKey is OBYPVXGEXMMHLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3O/c12-10-1-2-11(14-9-10)13-3-4-15-5-7-16-8-6-15/h1-2,9H,3-8H2,(H,13,14).
What are the key properties of 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine?
5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine has a molecular weight of 286.17 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-morpholin-4-ylethyl)pyridin-2-amine is sourced from PubChem (CID 23438259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).