methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate

C13H22N4O2 — CID 114132782

IUPACmethyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate
SMILESCCCN(CC)CCNc1cnc(C(=O)OC)cn1
InChIInChI=1S/C13H22N4O2/c1-4-7-17(5-2)8-6-14-12-10-15-11(9-16-12)13(18)19-3/h9-10H,4-8H2,1-3H3,(H,14,16)
InChIKeyLFNWWZRTFDYKQG-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.41
Rot. Bonds8

About methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate

methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate (PubChem CID 114132782) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate.

Molecular Properties

Compound Namemethyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate
PubChem CID114132782
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Namemethyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate
SMILESCCCN(CC)CCNc1cnc(C(=O)OC)cn1
InChIInChI=1S/C13H22N4O2/c1-4-7-17(5-2)8-6-14-12-10-15-11(9-16-12)13(18)19-3/h9-10H,4-8H2,1-3H3,(H,14,16)
InChIKeyLFNWWZRTFDYKQG-UHFFFAOYSA-N
XLogP1.41
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate 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

methyl 5-(butylamino)pyrazine-2-carboxylate
CID 68565370
N-butyl-N-ethyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374046
5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide
CID 109276273
methyl 5-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]pyrazine-2-carboxylate
CID 103772184
methyl 5-[(5-hydroxy-2,2-dimethylpentyl)amino]pyrazine-2-carboxylate
CID 106148777
methyl 5-[[1-oxo-1-(propylamino)propan-2-yl]amino]pyrazine-2-carboxylate
CID 114059751
N-(2-methoxyethyl)-5-(propylamino)pyrazine-2-carboxamide
CID 109270966
methyl 4-[[5-(propylamino)pyrazine-2-carbonyl]amino]benzoate
CID 109271104
methyl 5-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]pyrazine-2-carboxylate
CID 114186375
methyl 2-[[5-[2-(dimethylamino)ethylamino]pyrazine-2-carbonyl]amino]benzoate
CID 109277408
N-propyl-5-(propylamino)-N-(2,2,2-trifluoroethyl)pyrazine-2-carboxamide
CID 107374760
N-ethyl-5-hydrazinyl-N-propylpyrazine-2-carboxamide
CID 107378064

Frequently Asked Questions

What is the IUPAC name of methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate?
The IUPAC name of methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate (CID 114132782) is methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate.
What is the SMILES notation for methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate?
The canonical SMILES for methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate is CCCN(CC)CCNc1cnc(C(=O)OC)cn1.
What is the InChIKey of methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate?
The InChIKey is LFNWWZRTFDYKQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-4-7-17(5-2)8-6-14-12-10-15-11(9-16-12)13(18)19-3/h9-10H,4-8H2,1-3H3,(H,14,16).
What are the key properties of methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate?
methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate has a molecular weight of 266.34 g/mol, XLogP of 1.41, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-[2-[ethyl(propyl)amino]ethylamino]pyrazine-2-carboxylate is sourced from PubChem (CID 114132782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).