N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide

C13H22N4O2 — CID 102612509

IUPACN-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide
SMILESCOCCNC(=O)CCNC(C)c1nccnc1C
InChIInChI=1S/C13H22N4O2/c1-10(13-11(2)15-6-7-17-13)14-5-4-12(18)16-8-9-19-3/h6-7,10,14H,4-5,8-9H2,1-3H3,(H,16,18)
InChIKeyORNKKAYWUAMWMR-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.59
Rot. Bonds8

About N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide

N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide (PubChem CID 102612509) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide
PubChem CID102612509
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide
SMILESCOCCNC(=O)CCNC(C)c1nccnc1C
InChIInChI=1S/C13H22N4O2/c1-10(13-11(2)15-6-7-17-13)14-5-4-12(18)16-8-9-19-3/h6-7,10,14H,4-5,8-9H2,1-3H3,(H,16,18)
InChIKeyORNKKAYWUAMWMR-UHFFFAOYSA-N
XLogP0.59
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-3-[1-(1,3-thiazol-4-yl)ethylamino]propanamide
CID 115879102
N-(2-methoxyethyl)-3-[1-(4-methoxyphenyl)ethylamino]propanamide
CID 115712008
3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-(2-methoxyethyl)propanamide
CID 112700220
3-[1-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
CID 112700216
3-[1-(4-cyanophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
CID 115905492
3-[1-(3-bromophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
CID 115667940
3-[1-(3-methylpyrazin-2-yl)ethylamino]-1-piperidin-1-ylpropan-1-one
CID 102612475
N-(2-methoxyethyl)-3-[1-(4-methoxyphenyl)propan-2-ylamino]propanamide
CID 115711920
3-[1-(4-chlorophenyl)propan-2-ylamino]-N-(2-methoxyethyl)propanamide
CID 103910437
3-[(5,6-dimethylpyrazin-2-yl)amino]-N-(2-methoxyethyl)propanamide
CID 114476137
N-(2-methoxyethyl)-3-[(4-methoxy-4-methylpentan-2-yl)amino]propanamide
CID 113260438
2-methoxy-N-[3-(2-methoxyethylamino)-3-oxopropyl]propanamide
CID 112686354

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide?
The IUPAC name of N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide (CID 102612509) is N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide?
The canonical SMILES for N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide is COCCNC(=O)CCNC(C)c1nccnc1C.
What is the InChIKey of N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide?
The InChIKey is ORNKKAYWUAMWMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-10(13-11(2)15-6-7-17-13)14-5-4-12(18)16-8-9-19-3/h6-7,10,14H,4-5,8-9H2,1-3H3,(H,16,18).
What are the key properties of N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide?
N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide has a molecular weight of 266.34 g/mol, XLogP of 0.59, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-[1-(3-methylpyrazin-2-yl)ethylamino]propanamide is sourced from PubChem (CID 102612509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).