3-ethyl-1-propyl-2H-pyrazine

C9H16N2 — CID 141110669

IUPAC3-ethyl-1-propyl-2H-pyrazine
SMILESCCCN1C=CN=C(CC)C1
InChIInChI=1S/C9H16N2/c1-3-6-11-7-5-10-9(4-2)8-11/h5,7H,3-4,6,8H2,1-2H3
InChIKeyLQISJSWQMMNPDV-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.03
Rot. Bonds3

About 3-ethyl-1-propyl-2H-pyrazine

3-ethyl-1-propyl-2H-pyrazine (PubChem CID 141110669) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 3-ethyl-1-propyl-2H-pyrazine.

Molecular Properties

Compound Name3-ethyl-1-propyl-2H-pyrazine
PubChem CID141110669
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name3-ethyl-1-propyl-2H-pyrazine
SMILESCCCN1C=CN=C(CC)C1
InChIInChI=1S/C9H16N2/c1-3-6-11-7-5-10-9(4-2)8-11/h5,7H,3-4,6,8H2,1-2H3
InChIKeyLQISJSWQMMNPDV-UHFFFAOYSA-N
XLogP2.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-1-propyl-2H-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

Tetramethyldihydropyrazin
CID 21749018
2,4-Dimethylpyrazine
CID 23222672
3-Ethyl-2,4-dimethylpyrazine
CID 129728359
3-ethyl-1,1,6-trimethyl-2H-pyrazin-1-ium
CID 91163840
4-Ethyl-1,7-dimethyl-5,6-dihydro-1,4-diazepin-1-ium
CID 123307482
1-Butyl-4,5,7-trimethyl-1,4-diazoniabicyclo[4.1.0]hepta-2,4-diene
CID 123968282
N-butyl-N-methyl-3-[(Z)-prop-1-enyl]iminobutan-1-amine
CID 142257797
1,3-dimethyl-2H-pyrazine;ethane
CID 143096931
ethane;1,3,6-trimethyl-2H-pyrazine
CID 143336614
3-ethyl-1-methyl-2H-pyrazine
CID 145520112
N-ethenyl-N-methyl-2-methyliminobutan-1-amine
CID 145520134
1,3-diethyl-2H-pyrazine
CID 150747593

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-propyl-2H-pyrazine?
The IUPAC name of 3-ethyl-1-propyl-2H-pyrazine (CID 141110669) is 3-ethyl-1-propyl-2H-pyrazine.
What is the SMILES notation for 3-ethyl-1-propyl-2H-pyrazine?
The canonical SMILES for 3-ethyl-1-propyl-2H-pyrazine is CCCN1C=CN=C(CC)C1.
What is the InChIKey of 3-ethyl-1-propyl-2H-pyrazine?
The InChIKey is LQISJSWQMMNPDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-6-11-7-5-10-9(4-2)8-11/h5,7H,3-4,6,8H2,1-2H3.
What are the key properties of 3-ethyl-1-propyl-2H-pyrazine?
3-ethyl-1-propyl-2H-pyrazine has a molecular weight of 152.24 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-propyl-2H-pyrazine is sourced from PubChem (CID 141110669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).