N-(2-ethoxyethyl)-3-methylpyrazin-2-amine

C9H15N3O — CID 83064556

IUPACN-(2-ethoxyethyl)-3-methylpyrazin-2-amine
SMILESCCOCCNc1nccnc1C
InChIInChI=1S/C9H15N3O/c1-3-13-7-6-12-9-8(2)10-4-5-11-9/h4-5H,3,6-7H2,1-2H3,(H,11,12)
InChIKeyOQPCTMVKWPUOTL-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.23
Rot. Bonds5

About N-(2-ethoxyethyl)-3-methylpyrazin-2-amine

N-(2-ethoxyethyl)-3-methylpyrazin-2-amine (PubChem CID 83064556) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-3-methylpyrazin-2-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-3-methylpyrazin-2-amine
PubChem CID83064556
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC NameN-(2-ethoxyethyl)-3-methylpyrazin-2-amine
SMILESCCOCCNc1nccnc1C
InChIInChI=1S/C9H15N3O/c1-3-13-7-6-12-9-8(2)10-4-5-11-9/h4-5H,3,6-7H2,1-2H3,(H,11,12)
InChIKeyOQPCTMVKWPUOTL-UHFFFAOYSA-N
XLogP1.23
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyrazin-2-amine
CID 83064425
N-(4-methoxybutyl)-3-methylpyrazin-2-amine
CID 83063291
ethyl 4-[(3-methylpyrazin-2-yl)amino]butanoate
CID 83062864
ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine
CID 143756054
N'-(3-methylpyrazin-2-yl)propane-1,3-diamine
CID 83064699
3-methyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine
CID 83064931
N-[2-(3-aminophenoxy)ethyl]-3-methylpyrazin-2-amine
CID 83064262
5-bromo-N-(2-ethoxyethyl)isoquinolin-1-amine
CID 103847057
3-amino-2-(2-ethoxyethylamino)pyridine-4-carbonitrile
CID 82816731
N-(2-ethoxyethyl)-5-methoxyisoquinolin-1-amine
CID 106537643
5-bromo-N-(2-ethoxyethyl)pyrimidin-4-amine
CID 66340987
N-(2-ethoxyethyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104730730

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-3-methylpyrazin-2-amine?
The IUPAC name of N-(2-ethoxyethyl)-3-methylpyrazin-2-amine (CID 83064556) is N-(2-ethoxyethyl)-3-methylpyrazin-2-amine.
What is the SMILES notation for N-(2-ethoxyethyl)-3-methylpyrazin-2-amine?
The canonical SMILES for N-(2-ethoxyethyl)-3-methylpyrazin-2-amine is CCOCCNc1nccnc1C.
What is the InChIKey of N-(2-ethoxyethyl)-3-methylpyrazin-2-amine?
The InChIKey is OQPCTMVKWPUOTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-3-13-7-6-12-9-8(2)10-4-5-11-9/h4-5H,3,6-7H2,1-2H3,(H,11,12).
What are the key properties of N-(2-ethoxyethyl)-3-methylpyrazin-2-amine?
N-(2-ethoxyethyl)-3-methylpyrazin-2-amine has a molecular weight of 181.24 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-3-methylpyrazin-2-amine is sourced from PubChem (CID 83064556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).