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

C19H19ClN4O2 — CID 70778944

IUPAC6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide
SMILESCNC(=O)c1cn2cc(-c3ccccc3Cl)n(CC=C(C)C)c(=O)c2n1
InChIInChI=1S/C19H19ClN4O2/c1-12(2)8-9-24-16(13-6-4-5-7-14(13)20)11-23-10-15(18(25)21-3)22-17(23)19(24)26/h4-8,10-11H,9H2,1-3H3,(H,21,25)
InChIKeyFKRYKSUXGGZMSI-UHFFFAOYSA-N
MW370.84 g/mol
LogP3.14
Rot. Bonds4

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

6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 70778944) has the molecular formula C19H19ClN4O2 and a molecular weight of 370.84 g/mol. Its IUPAC name is 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID70778944
Molecular FormulaC19H19ClN4O2
Molecular Weight370.84 g/mol
Exact Mass370.12
IUPAC Name6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide
SMILESCNC(=O)c1cn2cc(-c3ccccc3Cl)n(CC=C(C)C)c(=O)c2n1
InChIInChI=1S/C19H19ClN4O2/c1-12(2)8-9-24-16(13-6-4-5-7-14(13)20)11-23-10-15(18(25)21-3)22-17(23)19(24)26/h4-8,10-11H,9H2,1-3H3,(H,21,25)
InChIKeyFKRYKSUXGGZMSI-UHFFFAOYSA-N
XLogP3.14
TPSA68.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.84
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-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

Pf-3463275
CID 44156901
7-(2-Chlorobenzyl)-1,3-Dimethyl-8-Piperazin-1-Yl-3,7-Dihydro-1h-Purine-2,6-Dione
CID 979136
(1-Benzyl-1h-Imidazol-4-Yl)[4-(2-Chlorophenyl)piperazin-1-Yl]methanone
CID 74983356
(6-(Aminomethyl)-5-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-2-yl)(pyrrolidin-1-yl)methanone
CID 11567606
4-(6-(Aminomethyl)-5-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyrimidine-2-carbonyl)piperazin-2-one
CID 46899593
N-[4-[4-(2-chloro-3-ethylphenyl)piperazin-1-yl]butyl]-5-methyl-1H-imidazole-2-carboxamide
CID 130431340
N-[4-[4-(2-chloro-3-ethylphenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 130431343
7-(2-chlorobenzyl)-3-methyl-8-(3-methylpiperidin-1-yl)-1H-purine-2,6(3H,7H)-dione
CID 3156041
Fenprinast
CID 53669
3-[(4-Chlorophenyl)methyl]-7-Ethyl-Purine-2,6-Dione
CID 112499930
1-(2,4-Dichloro-benzyl)-3,7-dimethyl-3,7-dihydro-purine-2,6-dione
CID 681798
6-(2,4-dichlorophenyl)-1-methyl-7H-imidazo[1,5-a]pyrazin-8-one
CID 2821943

Frequently Asked Questions

What is the IUPAC name of 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide (CID 70778944) is 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide is CNC(=O)c1cn2cc(-c3ccccc3Cl)n(CC=C(C)C)c(=O)c2n1.
What is the InChIKey of 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is FKRYKSUXGGZMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O2/c1-12(2)8-9-24-16(13-6-4-5-7-14(13)20)11-23-10-15(18(25)21-3)22-17(23)19(24)26/h4-8,10-11H,9H2,1-3H3,(H,21,25).
What are the key properties of 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide?
6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 370.84 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chlorophenyl)-N-methyl-7-(3-methylbut-2-enyl)-8-oxoimidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 70778944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).