3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine

C13H21N3 — CID 176683440

IUPAC3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine
SMILESCCC(C)c1cnc2c(n1)N(CC)CCC2
InChIInChI=1S/C13H21N3/c1-4-10(3)12-9-14-11-7-6-8-16(5-2)13(11)15-12/h9-10H,4-8H2,1-3H3
InChIKeyIVPDZFZOSPHEMR-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.76
Rot. Bonds3

About 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine

3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine (PubChem CID 176683440) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine
PubChem CID176683440
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine
SMILESCCC(C)c1cnc2c(n1)N(CC)CCC2
InChIInChI=1S/C13H21N3/c1-4-10(3)12-9-14-11-7-6-8-16(5-2)13(11)15-12/h9-10H,4-8H2,1-3H3
InChIKeyIVPDZFZOSPHEMR-UHFFFAOYSA-N
XLogP2.76
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[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

3,5-di(propan-2-yl)-6,7-dihydropyrrolo[2,3-b]pyrazine
CID 121384005
5-butan-2-yl-3-ethyl-2-methylpyrazine
CID 55254891
3-butan-2-yl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazin-4-one
CID 163139957
2-bromo-5-butan-2-ylpyrazine
CID 91862993
4-butan-2-yl-1-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine
CID 145006512
6-bromo-2-butan-2-ylimidazo[1,2-a]pyrimidine
CID 115404587
4-butan-2-yl-1-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine;ethane
CID 145006511
1-(6-butan-2-yl-3-pyridinyl)-4-methylpiperazine
CID 139538940
2-[(2R)-butan-2-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
CID 94985164
1-(6-butan-2-ylpyrimidin-4-yl)piperidin-4-one
CID 126848690
2-butan-2-yl-5-(2-methylbutan-2-yl)pyridine
CID 90395896
2-[(2S)-butan-2-yl]-4,5-dimethylpyridine
CID 163020641

Frequently Asked Questions

What is the IUPAC name of 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine?
The IUPAC name of 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine (CID 176683440) is 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine.
What is the SMILES notation for 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine?
The canonical SMILES for 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine is CCC(C)c1cnc2c(n1)N(CC)CCC2.
What is the InChIKey of 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine?
The InChIKey is IVPDZFZOSPHEMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-4-10(3)12-9-14-11-7-6-8-16(5-2)13(11)15-12/h9-10H,4-8H2,1-3H3.
What are the key properties of 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine?
3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine has a molecular weight of 219.33 g/mol, XLogP of 2.76, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butan-2-yl-5-ethyl-7,8-dihydro-6H-pyrido[2,3-b]pyrazine is sourced from PubChem (CID 176683440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).