methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate

C10H14N4O3 — CID 103772153

IUPACmethyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate
SMILESCNC(=O)CN(C)c1cnc(C(=O)OC)cn1
InChIInChI=1S/C10H14N4O3/c1-11-9(15)6-14(2)8-5-12-7(4-13-8)10(16)17-3/h4-5H,6H2,1-3H3,(H,11,15)
InChIKeyLBNCFTMBXINCIB-UHFFFAOYSA-N
MW238.25 g/mol
LogP-0.55
Rot. Bonds4

About methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate

methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate (PubChem CID 103772153) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate.

Molecular Properties

Compound Namemethyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate
PubChem CID103772153
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC Namemethyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate
SMILESCNC(=O)CN(C)c1cnc(C(=O)OC)cn1
InChIInChI=1S/C10H14N4O3/c1-11-9(15)6-14(2)8-5-12-7(4-13-8)10(16)17-3/h4-5H,6H2,1-3H3,(H,11,15)
InChIKeyLBNCFTMBXINCIB-UHFFFAOYSA-N
XLogP-0.55
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 5-[bis(2-methylpropyl)amino]pyrazine-2-carboxylate
CID 114059734
methyl 5-[methyl(4-methylpentan-2-yl)amino]pyrazine-2-carboxylate
CID 114059762
5-[[2-(3-methoxypropylamino)-2-oxoethyl]-methylamino]pyrazine-2-carboxylic acid
CID 122052812
methyl 5-[methyl(oxolan-2-ylmethyl)amino]pyrazine-2-carboxylate
CID 104696750
2-[(5-formyl-2-pyridinyl)-methylamino]-N-methylacetamide
CID 80637307
5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid
CID 104638770
methyl 5-(aminomethyl)pyrazine-2-carboxylate;hydrochloride
CID 67079097
2-[(2-aminopyrimidin-4-yl)-methylamino]-N-methylacetamide
CID 80779602
2-[[6-(aminomethyl)-3-pyridinyl]-methylamino]-N-methylacetamide
CID 115486849
2-[(2-chloropyrimidin-4-yl)-methylamino]-N-methylacetamide
CID 62342254
methyl 5-[2-ethoxyethyl(ethyl)amino]pyrazine-2-carboxylate
CID 114059804
2-[(5-aminopyrazin-2-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 80652005

Frequently Asked Questions

What is the IUPAC name of methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate?
The IUPAC name of methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate (CID 103772153) is methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate.
What is the SMILES notation for methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate?
The canonical SMILES for methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate is CNC(=O)CN(C)c1cnc(C(=O)OC)cn1.
What is the InChIKey of methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate?
The InChIKey is LBNCFTMBXINCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3/c1-11-9(15)6-14(2)8-5-12-7(4-13-8)10(16)17-3/h4-5H,6H2,1-3H3,(H,11,15).
What are the key properties of methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate?
methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate has a molecular weight of 238.25 g/mol, XLogP of -0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-[methyl-[2-(methylamino)-2-oxoethyl]amino]pyrazine-2-carboxylate is sourced from PubChem (CID 103772153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).