2-N-(oxolan-3-yl)pyrazine-2,6-diamine

C8H12N4O — CID 80714757

IUPAC2-N-(oxolan-3-yl)pyrazine-2,6-diamine
SMILESNc1cncc(NC2CCOC2)n1
InChIInChI=1S/C8H12N4O/c9-7-3-10-4-8(12-7)11-6-1-2-13-5-6/h3-4,6H,1-2,5H2,(H3,9,11,12)
InChIKeyKGVBIRFJMWTWSY-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.26
Rot. Bonds2

About 2-N-(oxolan-3-yl)pyrazine-2,6-diamine

2-N-(oxolan-3-yl)pyrazine-2,6-diamine (PubChem CID 80714757) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 2-N-(oxolan-3-yl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-(oxolan-3-yl)pyrazine-2,6-diamine
PubChem CID80714757
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name2-N-(oxolan-3-yl)pyrazine-2,6-diamine
SMILESNc1cncc(NC2CCOC2)n1
InChIInChI=1S/C8H12N4O/c9-7-3-10-4-8(12-7)11-6-1-2-13-5-6/h3-4,6H,1-2,5H2,(H3,9,11,12)
InChIKeyKGVBIRFJMWTWSY-UHFFFAOYSA-N
XLogP0.26
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-N-(oxolan-3-yl)pyrazine-2,6-diamine with MolForge

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

Launch Full Analysis

Related Compounds

2-N-cyclooctylpyrazine-2,6-diamine
CID 78988887
2-N-(oxolan-3-ylmethyl)pyrazine-2,6-diamine
CID 78988857
2-N-(1-methylpiperidin-4-yl)pyrazine-2,6-diamine
CID 80648000
2-N-(oxan-4-ylmethyl)pyrazine-2,6-diamine
CID 78989247
5-N-(oxolan-3-yl)pyridine-2,5-diamine
CID 80717069
N-(oxolan-3-yl)pyrimidin-5-amine
CID 83480544
6-N-(oxan-4-yl)pyridine-2,6-diamine
CID 80648181
2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
CID 78988868
4-N-(oxolan-3-yl)pyridine-3,4-diamine
CID 80717720
2-N-(oxolan-3-yl)pyridine-2,4-diamine
CID 80717438
N-[(3S)-oxan-3-yl]pyrazin-2-amine
CID 130628778
6-chloro-2-methyl-N-(oxolan-3-yl)pyrimidin-4-amine
CID 80713664

Frequently Asked Questions

What is the IUPAC name of 2-N-(oxolan-3-yl)pyrazine-2,6-diamine?
The IUPAC name of 2-N-(oxolan-3-yl)pyrazine-2,6-diamine (CID 80714757) is 2-N-(oxolan-3-yl)pyrazine-2,6-diamine.
What is the SMILES notation for 2-N-(oxolan-3-yl)pyrazine-2,6-diamine?
The canonical SMILES for 2-N-(oxolan-3-yl)pyrazine-2,6-diamine is Nc1cncc(NC2CCOC2)n1.
What is the InChIKey of 2-N-(oxolan-3-yl)pyrazine-2,6-diamine?
The InChIKey is KGVBIRFJMWTWSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c9-7-3-10-4-8(12-7)11-6-1-2-13-5-6/h3-4,6H,1-2,5H2,(H3,9,11,12).
What are the key properties of 2-N-(oxolan-3-yl)pyrazine-2,6-diamine?
2-N-(oxolan-3-yl)pyrazine-2,6-diamine has a molecular weight of 180.21 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(oxolan-3-yl)pyrazine-2,6-diamine is sourced from PubChem (CID 80714757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).