N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide

C21H17FN4O — CID 53189002

IUPACN-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1cn2ccnc(-c3ccc(F)cc3)c2n1
InChIInChI=1S/C21H17FN4O/c1-25(13-15-5-3-2-4-6-15)21(27)18-14-26-12-11-23-19(20(26)24-18)16-7-9-17(22)10-8-16/h2-12,14H,13H2,1H3
InChIKeyFOSCIRKDIWQDDB-UHFFFAOYSA-N
MW360.39 g/mol
LogP3.81
Rot. Bonds4

About N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide

N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 53189002) has the molecular formula C21H17FN4O and a molecular weight of 360.39 g/mol. Its IUPAC name is N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID53189002
Molecular FormulaC21H17FN4O
Molecular Weight360.39 g/mol
Exact Mass360.14
IUPAC NameN-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1cn2ccnc(-c3ccc(F)cc3)c2n1
InChIInChI=1S/C21H17FN4O/c1-25(13-15-5-3-2-4-6-15)21(27)18-14-26-12-11-23-19(20(26)24-18)16-7-9-17(22)10-8-16/h2-12,14H,13H2,1H3
InChIKeyFOSCIRKDIWQDDB-UHFFFAOYSA-N
XLogP3.81
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[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

Frequently Asked Questions

What is the IUPAC name of N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide (CID 53189002) is N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide is CN(Cc1ccccc1)C(=O)c1cn2ccnc(-c3ccc(F)cc3)c2n1.
What is the InChIKey of N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is FOSCIRKDIWQDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O/c1-25(13-15-5-3-2-4-6-15)21(27)18-14-26-12-11-23-19(20(26)24-18)16-7-9-17(22)10-8-16/h2-12,14H,13H2,1H3.
What are the key properties of N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide?
N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 360.39 g/mol, XLogP of 3.81, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-8-(4-fluorophenyl)-N-methylimidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 53189002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).