5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine

C13H15N5O — CID 122622421

IUPAC5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine
SMILESNc1ccc(-c2cnc(N3CCOCC3)nc2)cn1
InChIInChI=1S/C13H15N5O/c14-12-2-1-10(7-15-12)11-8-16-13(17-9-11)18-3-5-19-6-4-18/h1-2,7-9H,3-6H2,(H2,14,15)
InChIKeyCTKZMNDEADHEQX-UHFFFAOYSA-N
MW257.30 g/mol
LogP0.96
Rot. Bonds2

About 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine

5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine (PubChem CID 122622421) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine
PubChem CID122622421
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC Name5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine
SMILESNc1ccc(-c2cnc(N3CCOCC3)nc2)cn1
InChIInChI=1S/C13H15N5O/c14-12-2-1-10(7-15-12)11-8-16-13(17-9-11)18-3-5-19-6-4-18/h1-2,7-9H,3-6H2,(H2,14,15)
InChIKeyCTKZMNDEADHEQX-UHFFFAOYSA-N
XLogP0.96
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine?
The IUPAC name of 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine (CID 122622421) is 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine.
What is the SMILES notation for 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine?
The canonical SMILES for 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine is Nc1ccc(-c2cnc(N3CCOCC3)nc2)cn1.
What is the InChIKey of 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine?
The InChIKey is CTKZMNDEADHEQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c14-12-2-1-10(7-15-12)11-8-16-13(17-9-11)18-3-5-19-6-4-18/h1-2,7-9H,3-6H2,(H2,14,15).
What are the key properties of 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine?
5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine has a molecular weight of 257.30 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine is sourced from PubChem (CID 122622421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).