N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide

C18H22N4O2 — CID 134332166

IUPACN-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide
SMILESCCC(NC(=O)N1CC(=O)NC2=C1N=CCC2)c1ccc(C)cc1
InChIInChI=1S/C18H22N4O2/c1-3-14(13-8-6-12(2)7-9-13)21-18(24)22-11-16(23)20-15-5-4-10-19-17(15)22/h6-10,14H,3-5,11H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyFQTWOTRBDFNKCH-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.62
Rot. Bonds3

About N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide

N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide (PubChem CID 134332166) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide
PubChem CID134332166
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide
SMILESCCC(NC(=O)N1CC(=O)NC2=C1N=CCC2)c1ccc(C)cc1
InChIInChI=1S/C18H22N4O2/c1-3-14(13-8-6-12(2)7-9-13)21-18(24)22-11-16(23)20-15-5-4-10-19-17(15)22/h6-10,14H,3-5,11H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyFQTWOTRBDFNKCH-UHFFFAOYSA-N
XLogP2.62
TPSA73.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-methoxy-1-[4-(trifluoromethoxy)phenyl]ethyl]-6-methyl-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide
CID 134332208
N-[(1R)-1-(4-methylphenyl)propyl]-4-(thiophene-2-carbonyl)piperazine-1-carboxamide
CID 124507220
2-methyl-N-[(1S)-1-(4-methylphenyl)propyl]propanamide
CID 95358385
2-methyl-N-[1-(4-methylphenyl)propyl]butanamide
CID 134024126
2-(cyclopropylamino)-N-[1-(4-methylphenyl)propyl]acetamide
CID 60671799
4-cyclohexyloxy-N-[1-(4-methylphenyl)propyl]piperidine-1-carboxamide
CID 86874095
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1R)-1-(4-methylphenyl)propyl]acetamide
CID 7181954
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 42898114
1-methyl-N-[1-(4-methylphenyl)propyl]-6-oxopyridazine-3-carboxamide
CID 78777843
2-amino-N-[1-(4-methylphenyl)propyl]propanamide
CID 43707472
N-[1-(4-methylphenyl)propyl]-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
CID 112766088
N-[(1S)-1-(4-methylphenyl)propyl]-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide
CID 9143525

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide?
The IUPAC name of N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide (CID 134332166) is N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide.
What is the SMILES notation for N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide?
The canonical SMILES for N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide is CCC(NC(=O)N1CC(=O)NC2=C1N=CCC2)c1ccc(C)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide?
The InChIKey is FQTWOTRBDFNKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-3-14(13-8-6-12(2)7-9-13)21-18(24)22-11-16(23)20-15-5-4-10-19-17(15)22/h6-10,14H,3-5,11H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide?
N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)propyl]-2-oxo-1,3,7,8-tetrahydropyrido[2,3-b]pyrazine-4-carboxamide is sourced from PubChem (CID 134332166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).