1-propan-2-yl-2H-pyrazine

C7H12N2 — CID 20641789

IUPAC1-propan-2-yl-2H-pyrazine
SMILESCC(C)N1C=CN=CC1
InChIInChI=1S/C7H12N2/c1-7(2)9-5-3-8-4-6-9/h3-5,7H,6H2,1-2H3
InChIKeyOLMCLLKSBQPDCB-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.25
Rot. Bonds1

About 1-propan-2-yl-2H-pyrazine

1-propan-2-yl-2H-pyrazine (PubChem CID 20641789) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 1-propan-2-yl-2H-pyrazine.

Molecular Properties

Compound Name1-propan-2-yl-2H-pyrazine
PubChem CID20641789
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name1-propan-2-yl-2H-pyrazine
SMILESCC(C)N1C=CN=CC1
InChIInChI=1S/C7H12N2/c1-7(2)9-5-3-8-4-6-9/h3-5,7H,6H2,1-2H3
InChIKeyOLMCLLKSBQPDCB-UHFFFAOYSA-N
XLogP1.25
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-propan-2-yl-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

CID 21134130
CID 21134130
CID 90427580
CID 90427580
CID 90455649
CID 90455649
CID 17841205
CID 17841205
CID 20728182
CID 20728182
CID 23148541
CID 23148541
CID 23148550
CID 23148550
CID 23148557
CID 23148557
CID 23148560
CID 23148560
CID 23148573
CID 23148573
CID 53446009
CID 53446009
CID 54272638
CID 54272638

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-2H-pyrazine?
The IUPAC name of 1-propan-2-yl-2H-pyrazine (CID 20641789) is 1-propan-2-yl-2H-pyrazine.
What is the SMILES notation for 1-propan-2-yl-2H-pyrazine?
The canonical SMILES for 1-propan-2-yl-2H-pyrazine is CC(C)N1C=CN=CC1.
What is the InChIKey of 1-propan-2-yl-2H-pyrazine?
The InChIKey is OLMCLLKSBQPDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-7(2)9-5-3-8-4-6-9/h3-5,7H,6H2,1-2H3.
What are the key properties of 1-propan-2-yl-2H-pyrazine?
1-propan-2-yl-2H-pyrazine has a molecular weight of 124.19 g/mol, XLogP of 1.25, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-2H-pyrazine is sourced from PubChem (CID 20641789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).