6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide

C18H19ClN4O3 — CID 70719628

IUPAC6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide
SMILESCOCCCNC(=O)c1cn2cc(-c3ccccc3Cl)n(C)c(=O)c2n1
InChIInChI=1S/C18H19ClN4O3/c1-22-15(12-6-3-4-7-13(12)19)11-23-10-14(21-16(23)18(22)25)17(24)20-8-5-9-26-2/h3-4,6-7,10-11H,5,8-9H2,1-2H3,(H,20,24)
InChIKeyFABZKVRQGFKFSI-UHFFFAOYSA-N
MW374.83 g/mol
LogP2.12
Rot. Bonds6

About 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide

6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 70719628) has the molecular formula C18H19ClN4O3 and a molecular weight of 374.83 g/mol. Its IUPAC name is 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID70719628
Molecular FormulaC18H19ClN4O3
Molecular Weight374.83 g/mol
Exact Mass374.11
IUPAC Name6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide
SMILESCOCCCNC(=O)c1cn2cc(-c3ccccc3Cl)n(C)c(=O)c2n1
InChIInChI=1S/C18H19ClN4O3/c1-22-15(12-6-3-4-7-13(12)19)11-23-10-14(21-16(23)18(22)25)17(24)20-8-5-9-26-2/h3-4,6-7,10-11H,5,8-9H2,1-2H3,(H,20,24)
InChIKeyFABZKVRQGFKFSI-UHFFFAOYSA-N
XLogP2.12
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.83
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(2-chlorophenyl)-7-methyl-N-(2-methylbutyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide
CID 70729541
6-(2-chlorophenyl)-7-methyl-8-oxo-N-pentan-3-ylimidazo[1,2-a]pyrazine-2-carboxamide
CID 70782699
6-(2-chlorophenyl)-N-[(2R)-2-methoxybutyl]-8-oxo-7-prop-2-enylimidazo[1,2-a]pyrazine-2-carboxamide
CID 95867926
6-(2,5-dimethylfuran-3-yl)-7-methyl-8-oxo-N-(2-propan-2-yloxyethyl)imidazo[1,2-a]pyrazine-2-carboxamide
CID 70713720
6-(2-chlorophenyl)-N-[(2R)-2-hydroxybutyl]-8-oxo-7-prop-2-enylimidazo[1,2-a]pyrazine-2-carboxamide
CID 95880903
N-(3-methoxypropyl)-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134798579
6-(2-chloroanilino)-N-(3-methoxypropyl)-2-methylpyrimidine-4-carboxamide
CID 109365257
6-(2-chlorophenyl)-N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]-8-oxo-7-prop-2-enylimidazo[1,2-a]pyrazine-2-carboxamide
CID 95897267
N-[3-(2-methoxyethoxy)propyl]-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-7-carboxamide
CID 55929786
N-(3-methoxypropyl)-2-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134797314
N-(3-methoxypropyl)-4-methyl-3-oxopyrido[2,3-b]pyrazine-2-carboxamide
CID 53189744
1-amino-N-(3-methoxypropyl)pyrazino[1,2-a]benzimidazole-3-carboxamide
CID 170023223

Frequently Asked Questions

What is the IUPAC name of 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide (CID 70719628) is 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide is COCCCNC(=O)c1cn2cc(-c3ccccc3Cl)n(C)c(=O)c2n1.
What is the InChIKey of 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is FABZKVRQGFKFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN4O3/c1-22-15(12-6-3-4-7-13(12)19)11-23-10-14(21-16(23)18(22)25)17(24)20-8-5-9-26-2/h3-4,6-7,10-11H,5,8-9H2,1-2H3,(H,20,24).
What are the key properties of 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide?
6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 374.83 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chlorophenyl)-N-(3-methoxypropyl)-7-methyl-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 70719628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).