N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide

C19H25N5O3 — CID 5186435

IUPACN-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide
SMILESCOCCN(CCC(=O)NCCc1ccccn1)C(=O)c1cnc(C)cn1
InChIInChI=1S/C19H25N5O3/c1-15-13-23-17(14-22-15)19(26)24(11-12-27-2)10-7-18(25)21-9-6-16-5-3-4-8-20-16/h3-5,8,13-14H,6-7,9-12H2,1-2H3,(H,21,25)
InChIKeyVJVYMTADESQMEQ-UHFFFAOYSA-N
MW371.44 g/mol
LogP1.02
Rot. Bonds10

About N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide

N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide (PubChem CID 5186435) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide
PubChem CID5186435
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC NameN-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide
SMILESCOCCN(CCC(=O)NCCc1ccccn1)C(=O)c1cnc(C)cn1
InChIInChI=1S/C19H25N5O3/c1-15-13-23-17(14-22-15)19(26)24(11-12-27-2)10-7-18(25)21-9-6-16-5-3-4-8-20-16/h3-5,8,13-14H,6-7,9-12H2,1-2H3,(H,21,25)
InChIKeyVJVYMTADESQMEQ-UHFFFAOYSA-N
XLogP1.02
TPSA97.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide (CID 5186435) is N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide is COCCN(CCC(=O)NCCc1ccccn1)C(=O)c1cnc(C)cn1.
What is the InChIKey of N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide?
The InChIKey is VJVYMTADESQMEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-15-13-23-17(14-22-15)19(26)24(11-12-27-2)10-7-18(25)21-9-6-16-5-3-4-8-20-16/h3-5,8,13-14H,6-7,9-12H2,1-2H3,(H,21,25).
What are the key properties of N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide?
N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 1.02, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide is sourced from PubChem (CID 5186435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).