3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine

C7H9N3 — CID 91017102

IUPAC3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine
SMILESC1=CC2N=CCNC2N=C1
InChIInChI=1S/C7H9N3/c1-2-6-7(9-3-1)10-5-4-8-6/h1-4,6-7,10H,5H2
InChIKeyZAIYDHLBFNPSEH-UHFFFAOYSA-N
MW135.17 g/mol
LogP-0.00
Rot. Bonds

About 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine

3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine (PubChem CID 91017102) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine
PubChem CID91017102
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine
SMILESC1=CC2N=CCNC2N=C1
InChIInChI=1S/C7H9N3/c1-2-6-7(9-3-1)10-5-4-8-6/h1-4,6-7,10H,5H2
InChIKeyZAIYDHLBFNPSEH-UHFFFAOYSA-N
XLogP-0.00
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine 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

1,4,4a,8a-Tetrahydropyrido[2,3-b]pyrazine
CID 17810690
1-tert-butyl-3,4,4a,8a-tetrahydro-2H-pyrido[2,3-b]pyrazine
CID 58270271
(8aS)-4a-iodo-4,8a-dihydro-3H-pyrido[2,3-b]pyrazine
CID 67678531
1,2,4a,8a-Tetrahydroquinoxaline
CID 88984339
1,2,3,8a-Tetrahydro-1,5-naphthyridine
CID 91443759
(8aS)-1,2,4a,8a-tetrahydroquinoxaline
CID 91805170
1,4,4a,8a-Tetrahydropyrido[2,3-b]pyrazin-7-amine
CID 118167407
3-N,3-N'-dimethyl-2H-pyridine-3,3-diamine
CID 141225359
3-N,3-N'-di(propan-2-yl)-2H-pyridine-3,3-diamine
CID 141225360
3-N,3-N'-diethyl-2H-pyridine-3,3-diamine
CID 141225361
3-N,3-N'-dipropyl-2H-pyridine-3,3-diamine
CID 141225368
3-Methyl-1,2,4a,8a-tetrahydropyrido[2,3-b]pyrazine
CID 144564941

Frequently Asked Questions

What is the IUPAC name of 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine?
The IUPAC name of 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine (CID 91017102) is 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine.
What is the SMILES notation for 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine?
The canonical SMILES for 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine is C1=CC2N=CCNC2N=C1.
What is the InChIKey of 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine?
The InChIKey is ZAIYDHLBFNPSEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-2-6-7(9-3-1)10-5-4-8-6/h1-4,6-7,10H,5H2.
What are the key properties of 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine?
3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine has a molecular weight of 135.17 g/mol, XLogP of -0.00, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,4a,8a-tetrahydropyrido[2,3-b]pyrazine is sourced from PubChem (CID 91017102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).