4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide

C20H22N4O3 — CID 53189841

IUPAC4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide
SMILESCCCOc1ccc(CNC(=O)c2nc3cccnc3n(CC)c2=O)cc1
InChIInChI=1S/C20H22N4O3/c1-3-12-27-15-9-7-14(8-10-15)13-22-19(25)17-20(26)24(4-2)18-16(23-17)6-5-11-21-18/h5-11H,3-4,12-13H2,1-2H3,(H,22,25)
InChIKeyXLCXVFWFMITHQW-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.53
Rot. Bonds7

About 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide

4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide (PubChem CID 53189841) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide
PubChem CID53189841
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide
SMILESCCCOc1ccc(CNC(=O)c2nc3cccnc3n(CC)c2=O)cc1
InChIInChI=1S/C20H22N4O3/c1-3-12-27-15-9-7-14(8-10-15)13-22-19(25)17-20(26)24(4-2)18-16(23-17)6-5-11-21-18/h5-11H,3-4,12-13H2,1-2H3,(H,22,25)
InChIKeyXLCXVFWFMITHQW-UHFFFAOYSA-N
XLogP2.53
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-ethyl-N-[(4-methoxyphenyl)methyl]-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 53189785
4-benzyl-N-[(3-methoxyphenyl)methyl]-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 134798321
4-(4-methoxyphenyl)-3-oxo-N-[[4-(trifluoromethyl)phenyl]methyl]pyrido[2,3-b]pyrazine-2-carboxamide
CID 134799263
N-[(3-methylphenyl)methyl]-4-(2-methylpropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 53189896
1-ethyl-N-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619808
N-[(3,4-dimethoxyphenyl)methyl]-4-(4-ethyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393769
N-(1,3-benzodioxol-5-ylmethyl)-4-(2-methylpropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 134797046
4-(2-methylpropyl)-3-oxo-N-propan-2-ylpyrido[2,3-b]pyrazine-2-carboxamide
CID 53189854
N-[(4-butoxyphenyl)methyl]quinoline-6-carboxamide
CID 59192120
(3S)-3-[(3-ethylimidazo[4,5-b]pyridin-2-yl)methyl]-N-[(4-methoxyphenyl)methyl]pyrrolidine-1-carboxamide
CID 95112501
N-(cyclopropylmethyl)-4-(3-methoxypropyl)-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 134798713
3-(2-methylpropyl)-4-oxo-N-[(4-propoxyphenyl)methyl]phthalazine-1-carboxamide
CID 52654082

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide?
The IUPAC name of 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide (CID 53189841) is 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide.
What is the SMILES notation for 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide?
The canonical SMILES for 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide is CCCOc1ccc(CNC(=O)c2nc3cccnc3n(CC)c2=O)cc1.
What is the InChIKey of 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide?
The InChIKey is XLCXVFWFMITHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-3-12-27-15-9-7-14(8-10-15)13-22-19(25)17-20(26)24(4-2)18-16(23-17)6-5-11-21-18/h5-11H,3-4,12-13H2,1-2H3,(H,22,25).
What are the key properties of 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide?
4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide has a molecular weight of 366.42 g/mol, XLogP of 2.53, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-oxo-N-[(4-propoxyphenyl)methyl]pyrido[2,3-b]pyrazine-2-carboxamide is sourced from PubChem (CID 53189841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).