methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate

C13H21N3O3 — CID 66449281

IUPACmethyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate
SMILESCOCCN(CC(C)C)c1cncc(C(=O)OC)n1
InChIInChI=1S/C13H21N3O3/c1-10(2)9-16(5-6-18-3)12-8-14-7-11(15-12)13(17)19-4/h7-8,10H,5-6,9H2,1-4H3
InChIKeyWRGFLVLHPJCZMP-UHFFFAOYSA-N
MW267.33 g/mol
LogP1.37
Rot. Bonds7

About methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate

methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate (PubChem CID 66449281) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate.

Molecular Properties

Compound Namemethyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate
PubChem CID66449281
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC Namemethyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate
SMILESCOCCN(CC(C)C)c1cncc(C(=O)OC)n1
InChIInChI=1S/C13H21N3O3/c1-10(2)9-16(5-6-18-3)12-8-14-7-11(15-12)13(17)19-4/h7-8,10H,5-6,9H2,1-4H3
InChIKeyWRGFLVLHPJCZMP-UHFFFAOYSA-N
XLogP1.37
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 6-[2-methoxyethyl(2-methylpropyl)amino]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 6-[1-methoxypropan-2-yl(methyl)amino]pyrazine-2-carboxylate
CID 66456064
methyl 6-[bis(2-methoxy-2-oxoethyl)amino]pyrazine-2-carboxylate
CID 66456232
methyl 5-amino-6-[2-methoxyethyl(2-methylpropyl)amino]pyridine-2-carboxylate
CID 114405986
methyl 6-[2-aminoethyl(ethyl)amino]pyrazine-2-carboxylate
CID 114900602
methyl 6-[(2-methoxy-2-oxoethyl)-propan-2-ylamino]pyrazine-2-carboxylate
CID 66458598
6-[2-methoxyethyl(propan-2-yl)amino]pyrazine-2-carboxylic acid
CID 82950912
methyl 6-[3-(diethylamino)propyl-ethylamino]pyrazine-2-carboxylate
CID 102994007
methyl 6-[ethyl-(2-hydroxy-2-methylpropyl)amino]pyrazine-2-carboxylate
CID 79390457
methyl 5-[bis(2-methylpropyl)amino]pyrazine-2-carboxylate
CID 114059734
methyl 6-[methyl(2-methylsulfonylethyl)amino]pyrazine-2-carboxylate
CID 79858166
3-chloro-6-[2-methoxyethyl(2-methylpropyl)amino]pyridine-2-carboxylic acid
CID 54986470
methyl 6-(2-methylpropoxy)pyrazine-2-carboxylate
CID 66456879

Frequently Asked Questions

What is the IUPAC name of methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate?
The IUPAC name of methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate (CID 66449281) is methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate.
What is the SMILES notation for methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate?
The canonical SMILES for methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate is COCCN(CC(C)C)c1cncc(C(=O)OC)n1.
What is the InChIKey of methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate?
The InChIKey is WRGFLVLHPJCZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3/c1-10(2)9-16(5-6-18-3)12-8-14-7-11(15-12)13(17)19-4/h7-8,10H,5-6,9H2,1-4H3.
What are the key properties of methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate?
methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate has a molecular weight of 267.33 g/mol, XLogP of 1.37, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-[2-methoxyethyl(2-methylpropyl)amino]pyrazine-2-carboxylate is sourced from PubChem (CID 66449281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).