ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile

C16H25N5O — CID 142379097

IUPACethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile
SMILESCC.CC.COc1cnc(C)cn1.Cc1cnc(C#N)cn1
InChIInChI=1S/C6H5N3.C6H8N2O.2C2H6/c1-5-3-9-6(2-7)4-8-5;1-5-3-8-6(9-2)4-7-5;2*1-2/h3-4H,1H3;3-4H,1-2H3;2*1-2H3
InChIKeyZRADVHDXLPRUOY-UHFFFAOYSA-N
MW303.41 g/mol
LogP3.50
Rot. Bonds1

About ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile

ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile (PubChem CID 142379097) has the molecular formula C16H25N5O and a molecular weight of 303.41 g/mol. Its IUPAC name is ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile.

Molecular Properties

Compound Nameethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile
PubChem CID142379097
Molecular FormulaC16H25N5O
Molecular Weight303.41 g/mol
Exact Mass303.21
IUPAC Nameethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile
SMILESCC.CC.COc1cnc(C)cn1.Cc1cnc(C#N)cn1
InChIInChI=1S/C6H5N3.C6H8N2O.2C2H6/c1-5-3-9-6(2-7)4-8-5;1-5-3-8-6(9-2)4-7-5;2*1-2/h3-4H,1H3;3-4H,1-2H3;2*1-2H3
InChIKeyZRADVHDXLPRUOY-UHFFFAOYSA-N
XLogP3.50
TPSA84.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile 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

5-[2-(5-methylpyrazin-2-yl)ethynyl]pyrazine-2-carbonitrile
CID 135303516
3-deuterio-5-methylpyrazine-2-carbonitrile
CID 59374869
2-(5-methoxypyrazin-2-yl)ethynyl-trimethylsilane
CID 90303128
5-(2-bromo-4-methoxyphenoxy)pyrazine-2-carbonitrile
CID 104707141
5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile
CID 81341848
5-(oxetan-3-yloxy)pyrazine-2-carbonitrile
CID 102606284
2,5-dimethylpyrazine;ethane
CID 143125119
5-(1-ethynylcyclopropyl)oxypyrazine-2-carbonitrile
CID 164653145
5-[2-(2-ethoxyethoxy)ethoxy]pyrazine-2-carbonitrile
CID 118625764
5-[(6-methoxy-3-pyridinyl)amino]pyridine-2-carbonitrile
CID 115487437
ethane;methoxymethane;5-methylpyridine-2-carbonitrile
CID 176990243
5-(3-fluoro-4-methylphenoxy)pyrazine-2-carbonitrile
CID 99836740

Frequently Asked Questions

What is the IUPAC name of ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile?
The IUPAC name of ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile (CID 142379097) is ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile.
What is the SMILES notation for ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile?
The canonical SMILES for ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile is CC.CC.COc1cnc(C)cn1.Cc1cnc(C#N)cn1.
What is the InChIKey of ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile?
The InChIKey is ZRADVHDXLPRUOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3.C6H8N2O.2C2H6/c1-5-3-9-6(2-7)4-8-5;1-5-3-8-6(9-2)4-7-5;2*1-2/h3-4H,1H3;3-4H,1-2H3;2*1-2H3.
What are the key properties of ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile?
ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile has a molecular weight of 303.41 g/mol, XLogP of 3.50, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methoxy-5-methylpyrazine;5-methylpyrazine-2-carbonitrile is sourced from PubChem (CID 142379097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).