2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine

C10H16N2O — CID 528135

IUPAC2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine
SMILESCOc1ncc(CC(C)C)nc1C
InChIInChI=1S/C10H16N2O/c1-7(2)5-9-6-11-10(13-4)8(3)12-9/h6-7H,5H2,1-4H3
InChIKeyRSRBELMBYIBNLC-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.99
Rot. Bonds3

About 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine

2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine (PubChem CID 528135) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine.

Molecular Properties

Compound Name2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine
PubChem CID528135
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine
SMILESCOc1ncc(CC(C)C)nc1C
InChIInChI=1S/C10H16N2O/c1-7(2)5-9-6-11-10(13-4)8(3)12-9/h6-7H,5H2,1-4H3
InChIKeyRSRBELMBYIBNLC-UHFFFAOYSA-N
XLogP1.99
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Isobutyl-3-methoxypyrazine
CID 32594
2-Isopropyl-3-methoxypyrazine
CID 33166
2-Methoxy-3-(1-methylpropyl)pyrazine
CID 520098
2-Ethyl-3-methoxypyrazine
CID 33135
2-Methoxy-3-propylpyrazine
CID 528308
2-Ethoxy-3-isopropylpyrazine
CID 175170
Pyrazine, 2-methoxy-3-(4-methylpentyl)-
CID 111647
2-Methoxy-3-isopropyl-5-methylpyrazine
CID 15590168
2-Isopropyl-5-methoxypyrazine
CID 92558
2-Isopropyl-6-methoxypyrazine
CID 106441
Pyrazine, 2-hexyl-3-methoxy
CID 528305
2-Butyl-3-methoxypyrazine
CID 528313

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine?
The IUPAC name of 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine (CID 528135) is 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine.
What is the SMILES notation for 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine?
The canonical SMILES for 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine is COc1ncc(CC(C)C)nc1C.
What is the InChIKey of 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine?
The InChIKey is RSRBELMBYIBNLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-7(2)5-9-6-11-10(13-4)8(3)12-9/h6-7H,5H2,1-4H3.
What are the key properties of 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine?
2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine has a molecular weight of 180.25 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-methyl-5-(2-methylpropyl)pyrazine is sourced from PubChem (CID 528135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).