2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide

C10H17N5O2 — CID 80652005

IUPAC2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C)c1cnc(N)cn1
InChIInChI=1S/C10H17N5O2/c1-15(7-10(16)12-3-4-17-2)9-6-13-8(11)5-14-9/h5-6H,3-4,7H2,1-2H3,(H2,11,13)(H,12,16)
InChIKeyDDKVFAUWVDOFLO-UHFFFAOYSA-N
MW239.28 g/mol
LogP-0.74
Rot. Bonds6

About 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide

2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide (PubChem CID 80652005) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
PubChem CID80652005
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C)c1cnc(N)cn1
InChIInChI=1S/C10H17N5O2/c1-15(7-10(16)12-3-4-17-2)9-6-13-8(11)5-14-9/h5-6H,3-4,7H2,1-2H3,(H2,11,13)(H,12,16)
InChIKeyDDKVFAUWVDOFLO-UHFFFAOYSA-N
XLogP-0.74
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[(5-formyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 80638047
5-[[2-(3-methoxypropylamino)-2-oxoethyl]-methylamino]pyrazine-2-carboxylic acid
CID 122052812
2-[(6-amino-3-pyridinyl)methyl-methylamino]-N-(2-methoxyethyl)acetamide
CID 62209093
2-[(3-aminoquinolin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 103963088
N-(2-methoxyethyl)-2-[methyl-[5-(propylaminomethyl)-2-pyridinyl]amino]acetamide
CID 80632056
N-(2-methoxyethyl)-2-[methyl-[6-(methylamino)pyrimidin-4-yl]amino]acetamide
CID 80806380
2-[(3-amino-6-methyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 81132098
2-[(6-carbamothioyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 64587464
2-[(5-amino-3-bromo-4-methyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 104506622
2-[(5-amino-6-oxo-1H-pyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 137009322
2-[(4,6-dichloro-1,3,5-triazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 55023792
2-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]-N-(2-methoxyethyl)acetamide
CID 80940171

Frequently Asked Questions

What is the IUPAC name of 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide (CID 80652005) is 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN(C)c1cnc(N)cn1.
What is the InChIKey of 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide?
The InChIKey is DDKVFAUWVDOFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-15(7-10(16)12-3-4-17-2)9-6-13-8(11)5-14-9/h5-6H,3-4,7H2,1-2H3,(H2,11,13)(H,12,16).
What are the key properties of 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide?
2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide has a molecular weight of 239.28 g/mol, XLogP of -0.74, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 80652005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).