3-morpholin-4-ylpyrazin-2-amine

C8H12N4O — CID 45480314

IUPAC3-morpholin-4-ylpyrazin-2-amine
SMILESNc1nccnc1N1CCOCC1
InChIInChI=1S/C8H12N4O/c9-7-8(11-2-1-10-7)12-3-5-13-6-4-12/h1-2H,3-6H2,(H2,9,10)
InChIKeyNTDKLDOLZNULLH-UHFFFAOYSA-N
MW180.21 g/mol
LogP-0.10
Rot. Bonds1

About 3-morpholin-4-ylpyrazin-2-amine

3-morpholin-4-ylpyrazin-2-amine (PubChem CID 45480314) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 3-morpholin-4-ylpyrazin-2-amine.

Molecular Properties

Compound Name3-morpholin-4-ylpyrazin-2-amine
PubChem CID45480314
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name3-morpholin-4-ylpyrazin-2-amine
SMILESNc1nccnc1N1CCOCC1
InChIInChI=1S/C8H12N4O/c9-7-8(11-2-1-10-7)12-3-5-13-6-4-12/h1-2H,3-6H2,(H2,9,10)
InChIKeyNTDKLDOLZNULLH-UHFFFAOYSA-N
XLogP-0.10
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-morpholin-4-ylpyrazin-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-ylpyrazin-2-amine?
The IUPAC name of 3-morpholin-4-ylpyrazin-2-amine (CID 45480314) is 3-morpholin-4-ylpyrazin-2-amine.
What is the SMILES notation for 3-morpholin-4-ylpyrazin-2-amine?
The canonical SMILES for 3-morpholin-4-ylpyrazin-2-amine is Nc1nccnc1N1CCOCC1.
What is the InChIKey of 3-morpholin-4-ylpyrazin-2-amine?
The InChIKey is NTDKLDOLZNULLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c9-7-8(11-2-1-10-7)12-3-5-13-6-4-12/h1-2H,3-6H2,(H2,9,10).
What are the key properties of 3-morpholin-4-ylpyrazin-2-amine?
3-morpholin-4-ylpyrazin-2-amine has a molecular weight of 180.21 g/mol, XLogP of -0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-ylpyrazin-2-amine is sourced from PubChem (CID 45480314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).