4-morpholin-4-ylpyridin-3-amine

C9H13N3O — CID 3060378

IUPAC4-morpholin-4-ylpyridin-3-amine
SMILESNc1cnccc1N1CCOCC1
InChIInChI=1S/C9H13N3O/c10-8-7-11-2-1-9(8)12-3-5-13-6-4-12/h1-2,7H,3-6,10H2
InChIKeyQSJJDPGQZUUPSZ-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.50
Rot. Bonds1

About 4-morpholin-4-ylpyridin-3-amine

4-morpholin-4-ylpyridin-3-amine (PubChem CID 3060378) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 4-morpholin-4-ylpyridin-3-amine.

Molecular Properties

Compound Name4-morpholin-4-ylpyridin-3-amine
PubChem CID3060378
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name4-morpholin-4-ylpyridin-3-amine
SMILESNc1cnccc1N1CCOCC1
InChIInChI=1S/C9H13N3O/c10-8-7-11-2-1-9(8)12-3-5-13-6-4-12/h1-2,7H,3-6,10H2
InChIKeyQSJJDPGQZUUPSZ-UHFFFAOYSA-N
XLogP0.50
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylpyridin-3-amine?
The IUPAC name of 4-morpholin-4-ylpyridin-3-amine (CID 3060378) is 4-morpholin-4-ylpyridin-3-amine.
What is the SMILES notation for 4-morpholin-4-ylpyridin-3-amine?
The canonical SMILES for 4-morpholin-4-ylpyridin-3-amine is Nc1cnccc1N1CCOCC1.
What is the InChIKey of 4-morpholin-4-ylpyridin-3-amine?
The InChIKey is QSJJDPGQZUUPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c10-8-7-11-2-1-9(8)12-3-5-13-6-4-12/h1-2,7H,3-6,10H2.
What are the key properties of 4-morpholin-4-ylpyridin-3-amine?
4-morpholin-4-ylpyridin-3-amine has a molecular weight of 179.22 g/mol, XLogP of 0.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylpyridin-3-amine is sourced from PubChem (CID 3060378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).