ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine

C12H23N3O — CID 169251343

IUPACethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine
SMILESCC.CO.Cc1cncc(N2CCCC2)n1
InChIInChI=1S/C9H13N3.C2H6.CH4O/c1-8-6-10-7-9(11-8)12-4-2-3-5-12;2*1-2/h6-7H,2-5H2,1H3;1-2H3;2H,1H3
InChIKeyPOSYKKHRUVQZTH-UHFFFAOYSA-N
MW225.34 g/mol
LogP2.02
Rot. Bonds1

About ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine

ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine (PubChem CID 169251343) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine.

Molecular Properties

Compound Nameethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine
PubChem CID169251343
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Nameethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine
SMILESCC.CO.Cc1cncc(N2CCCC2)n1
InChIInChI=1S/C9H13N3.C2H6.CH4O/c1-8-6-10-7-9(11-8)12-4-2-3-5-12;2*1-2/h6-7H,2-5H2,1H3;1-2H3;2H,1H3
InChIKeyPOSYKKHRUVQZTH-UHFFFAOYSA-N
XLogP2.02
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine 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

4-methyl-6-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]-2-pyrrolidin-1-ylpyrimidine
CID 155799816
2-(4-cyclopropylpiperazin-1-yl)-6-methylpyrazine
CID 133468968
(3R)-1-(6-methylpyrazin-2-yl)pyrrolidin-3-ol
CID 129412688
N-(3-methylbutan-2-yl)-1-(6-methylpyrazin-2-yl)piperidine-4-carboxamide
CID 133469352
N,N-diethyl-1-(6-methylpyrazin-2-yl)piperidine-4-carboxamide
CID 133469122
2-(3-methoxypiperidin-1-yl)-6-methylpyrazine
CID 133470094
N-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]acetamide
CID 171327953
(3S)-1-(6-methylpyrazin-2-yl)piperidine-3-carbaldehyde
CID 42555979
[1-(6-methylpyrazin-2-yl)piperidin-3-yl]-thiomorpholin-4-ylmethanone
CID 155799937
2-propan-2-yl-6-pyrrolidin-1-ylpyrazine
CID 58008643
2-cyclohexyl-1-[4-(6-methylpyrazin-2-yl)piperazin-1-yl]ethanone
CID 133469560
3-[1-(6-methylpyrazin-2-yl)piperidin-4-yl]-6-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine
CID 126912401

Frequently Asked Questions

What is the IUPAC name of ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine?
The IUPAC name of ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine (CID 169251343) is ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine.
What is the SMILES notation for ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine?
The canonical SMILES for ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine is CC.CO.Cc1cncc(N2CCCC2)n1.
What is the InChIKey of ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine?
The InChIKey is POSYKKHRUVQZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3.C2H6.CH4O/c1-8-6-10-7-9(11-8)12-4-2-3-5-12;2*1-2/h6-7H,2-5H2,1H3;1-2H3;2H,1H3.
What are the key properties of ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine?
ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine has a molecular weight of 225.34 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methanol;2-methyl-6-pyrrolidin-1-ylpyrazine is sourced from PubChem (CID 169251343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).