3-morpholin-4-ylpyridin-2-amine

C9H13N3O — CID 57494525

IUPAC3-morpholin-4-ylpyridin-2-amine
SMILESNc1ncccc1N1CCOCC1
InChIInChI=1S/C9H13N3O/c10-9-8(2-1-3-11-9)12-4-6-13-7-5-12/h1-3H,4-7H2,(H2,10,11)
InChIKeyKSRWGJRHJUQFTH-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.50
Rot. Bonds1

About 3-morpholin-4-ylpyridin-2-amine

3-morpholin-4-ylpyridin-2-amine (PubChem CID 57494525) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 3-morpholin-4-ylpyridin-2-amine.

Molecular Properties

Compound Name3-morpholin-4-ylpyridin-2-amine
PubChem CID57494525
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name3-morpholin-4-ylpyridin-2-amine
SMILESNc1ncccc1N1CCOCC1
InChIInChI=1S/C9H13N3O/c10-9-8(2-1-3-11-9)12-4-6-13-7-5-12/h1-3H,4-7H2,(H2,10,11)
InChIKeyKSRWGJRHJUQFTH-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

Analyze 3-morpholin-4-ylpyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-ylpyridin-2-amine?
The IUPAC name of 3-morpholin-4-ylpyridin-2-amine (CID 57494525) is 3-morpholin-4-ylpyridin-2-amine.
What is the SMILES notation for 3-morpholin-4-ylpyridin-2-amine?
The canonical SMILES for 3-morpholin-4-ylpyridin-2-amine is Nc1ncccc1N1CCOCC1.
What is the InChIKey of 3-morpholin-4-ylpyridin-2-amine?
The InChIKey is KSRWGJRHJUQFTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c10-9-8(2-1-3-11-9)12-4-6-13-7-5-12/h1-3H,4-7H2,(H2,10,11).
What are the key properties of 3-morpholin-4-ylpyridin-2-amine?
3-morpholin-4-ylpyridin-2-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 3-morpholin-4-ylpyridin-2-amine is sourced from PubChem (CID 57494525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).