4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide

C18H18N4O3 — CID 54680638

IUPAC4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide
SMILESCC(C)Cn1c(=O)c(C(=O)Nc2cnccn2)c(O)c2ccccc21
InChIInChI=1S/C18H18N4O3/c1-11(2)10-22-13-6-4-3-5-12(13)16(23)15(18(22)25)17(24)21-14-9-19-7-8-20-14/h3-9,11,23H,10H2,1-2H3,(H,20,21,24)
InChIKeyCGCYUIPCYFRWEY-UHFFFAOYSA-N
MW338.37 g/mol
LogP2.41
Rot. Bonds4

About 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide

4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide (PubChem CID 54680638) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide
PubChem CID54680638
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC Name4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide
SMILESCC(C)Cn1c(=O)c(C(=O)Nc2cnccn2)c(O)c2ccccc21
InChIInChI=1S/C18H18N4O3/c1-11(2)10-22-13-6-4-3-5-12(13)16(23)15(18(22)25)17(24)21-14-9-19-7-8-20-14/h3-9,11,23H,10H2,1-2H3,(H,20,21,24)
InChIKeyCGCYUIPCYFRWEY-UHFFFAOYSA-N
XLogP2.41
TPSA97.11 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide 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

1-(4-fluorobenzyl)-4-hydroxy-N-((1r,4r)-4-methylcyclohexyl)-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxamide
CID 118735890
1-hexyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3-carboxamide
CID 54677435
1-heptyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3-carboxamide
CID 54688352
1-butyl-2-hydroxy-4-oxo-N-pyrazin-2-ylquinoline-3-carboxamide
CID 54690395
1-Hydroxy-3-oxo-6,7-dihydro-3H,5H-pyrido[3,2,1-ij]quinoline-2-carboxylic acid pyridin-2-ylamide
CID 54683759
4-hydroxy-1-methyl-2-oxo-N-(pyridin-2-yl)-1,2-dihydroquinoline-3-carboxamide
CID 54684094
1-ethyl-4-hydroxy-2-oxo-N-(pyridin-2-yl)-1,2-dihydroquinoline-3-carboxamide
CID 54684095
4-hydroxy-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide
CID 54696285
1-Benzyl-4-hydroxy-2-oxo-1,2-dihydro-[1,8]-naphthyridine-3-carboxylic Acid Cyclohexylamide
CID 59699565
4-hydroxy-N-(3-hydroxypyridin-2-yl)-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxamide
CID 54679520
4-hydroxy-1-methyl-2-oxo-N-(pyrimidin-2-yl)-1,2-dihydroquinoline-3-carboxamide
CID 54678750
1,8-Naphthyridine-3-carboxamide, 1,2-dihydro-4-hydroxy-2-oxo-1-phenyl-N-3-pyridinyl-
CID 54684694

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide?
The IUPAC name of 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide (CID 54680638) is 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide.
What is the SMILES notation for 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide?
The canonical SMILES for 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide is CC(C)Cn1c(=O)c(C(=O)Nc2cnccn2)c(O)c2ccccc21.
What is the InChIKey of 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide?
The InChIKey is CGCYUIPCYFRWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c1-11(2)10-22-13-6-4-3-5-12(13)16(23)15(18(22)25)17(24)21-14-9-19-7-8-20-14/h3-9,11,23H,10H2,1-2H3,(H,20,21,24).
What are the key properties of 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide?
4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide has a molecular weight of 338.37 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-(2-methylpropyl)-2-oxo-N-pyrazin-2-ylquinoline-3-carboxamide is sourced from PubChem (CID 54680638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).