3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one

C13H24N4O2 — CID 55156809

IUPAC3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one
SMILESCCCn1ccnc(NCCN(C)CCOC)c1=O
InChIInChI=1S/C13H24N4O2/c1-4-7-17-9-6-15-12(13(17)18)14-5-8-16(2)10-11-19-3/h6,9H,4-5,7-8,10-11H2,1-3H3,(H,14,15)
InChIKeyXTNFSABEZRIBRD-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.64
Rot. Bonds9

About 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one

3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one (PubChem CID 55156809) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one.

Molecular Properties

Compound Name3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one
PubChem CID55156809
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC Name3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one
SMILESCCCn1ccnc(NCCN(C)CCOC)c1=O
InChIInChI=1S/C13H24N4O2/c1-4-7-17-9-6-15-12(13(17)18)14-5-8-16(2)10-11-19-3/h6,9H,4-5,7-8,10-11H2,1-3H3,(H,14,15)
InChIKeyXTNFSABEZRIBRD-UHFFFAOYSA-N
XLogP0.64
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one 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

3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-(2-methylpropyl)pyrazin-2-one
CID 62929520
3-(3-chloropropylamino)-1-propylpyrazin-2-one
CID 65030283
3-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-1-propylpyrazin-2-one
CID 55157178
3-[3-(2-chloroethoxy)propylamino]-1-propylpyrazin-2-one
CID 114171266
3-[2-(3-methylbutoxy)ethylamino]-1-propylpyrazin-2-one
CID 62927925
3-(5-chloropentylamino)-1-propylpyrazin-2-one
CID 107320514
3-[2-[ethyl(methyl)amino]ethylamino]-1-methylpyrazin-2-one
CID 62938529
2-[(3-oxo-4-propylpyrazin-2-yl)amino]ethylurea
CID 83113430
4-[(3-oxo-4-propylpyrazin-2-yl)amino]butanamide
CID 62940196
3-(4-chloropentylamino)-1-propylpyrazin-2-one
CID 106124558
N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 62849226
2-methyl-4-[(3-oxo-4-propylpyrazin-2-yl)amino]butanoic acid
CID 80539578

Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one?
The IUPAC name of 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one (CID 55156809) is 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one.
What is the SMILES notation for 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one?
The canonical SMILES for 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one is CCCn1ccnc(NCCN(C)CCOC)c1=O.
What is the InChIKey of 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one?
The InChIKey is XTNFSABEZRIBRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c1-4-7-17-9-6-15-12(13(17)18)14-5-8-16(2)10-11-19-3/h6,9H,4-5,7-8,10-11H2,1-3H3,(H,14,15).
What are the key properties of 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one?
3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one has a molecular weight of 268.36 g/mol, XLogP of 0.64, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-1-propylpyrazin-2-one is sourced from PubChem (CID 55156809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).