N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide

C14H26N4O2 — CID 158794501

IUPACN,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide
SMILESCCN(CC)CC.CON(C)C(=O)c1cnc(C)cn1
InChIInChI=1S/C8H11N3O2.C6H15N/c1-6-4-10-7(5-9-6)8(12)11(2)13-3;1-4-7(5-2)6-3/h4-5H,1-3H3;4-6H2,1-3H3
InChIKeyISRSUUUPKFBTHO-UHFFFAOYSA-N
MW282.39 g/mol
LogP1.77
Rot. Bonds5

About N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide

N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide (PubChem CID 158794501) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide
PubChem CID158794501
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC NameN,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide
SMILESCCN(CC)CC.CON(C)C(=O)c1cnc(C)cn1
InChIInChI=1S/C8H11N3O2.C6H15N/c1-6-4-10-7(5-9-6)8(12)11(2)13-3;1-4-7(5-2)6-3/h4-5H,1-3H3;4-6H2,1-3H3
InChIKeyISRSUUUPKFBTHO-UHFFFAOYSA-N
XLogP1.77
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethyl 2-[methyl-(5-methylpyrazine-2-carbonyl)amino]acetate
CID 55003335
5-ethyl-N-methoxy-N-methylpyridine-2-carboxamide
CID 23143535
methyl 3-[methyl-(5-methylpyrazine-2-carbonyl)amino]propanoate
CID 54980123
N-(2-aminoethyl)-N,5-dimethylpyrazine-2-carboxamide
CID 62686428
N-methoxy-N,6-dimethylpyrimidine-4-carboxamide
CID 121395327
N,N-dicyclopentyl-5-methylpyrazine-2-carboxamide
CID 86768809
N-cyclopentyl-N-cyclopropyl-5-methylpyrazine-2-carboxamide
CID 52568354
5-chloro-N-methoxy-N-methylpyridine-2-carboxamide
CID 59108636
N-(4-aminocyclohexyl)-N-ethyl-5-methylpyrazine-2-carboxamide
CID 79115750
N-methoxy-N-methyl-5-nitropyridine-2-carboxamide
CID 169122058
N,5-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]pyrazine-2-carboxamide
CID 77082230
5-methyl-N-propylpyrazine-2-carboxamide
CID 60637750

Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide?
The IUPAC name of N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide (CID 158794501) is N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide.
What is the SMILES notation for N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide?
The canonical SMILES for N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide is CCN(CC)CC.CON(C)C(=O)c1cnc(C)cn1.
What is the InChIKey of N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide?
The InChIKey is ISRSUUUPKFBTHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2.C6H15N/c1-6-4-10-7(5-9-6)8(12)11(2)13-3;1-4-7(5-2)6-3/h4-5H,1-3H3;4-6H2,1-3H3.
What are the key properties of N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide?
N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide has a molecular weight of 282.39 g/mol, XLogP of 1.77, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethanamine;N-methoxy-N,5-dimethylpyrazine-2-carboxamide is sourced from PubChem (CID 158794501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).