5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide

C21H19FN4O — CID 109284439

IUPAC5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide
SMILESO=C(NCCc1ccc(F)cc1)c1cnc(N2CCc3ccccc32)cn1
InChIInChI=1S/C21H19FN4O/c22-17-7-5-15(6-8-17)9-11-23-21(27)18-13-25-20(14-24-18)26-12-10-16-3-1-2-4-19(16)26/h1-8,13-14H,9-12H2,(H,23,27)
InChIKeyNCWCJNMDRRFXDD-UHFFFAOYSA-N
MW362.41 g/mol
LogP3.28
Rot. Bonds5

About 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide

5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide (PubChem CID 109284439) has the molecular formula C21H19FN4O and a molecular weight of 362.41 g/mol. Its IUPAC name is 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide
PubChem CID109284439
Molecular FormulaC21H19FN4O
Molecular Weight362.41 g/mol
Exact Mass362.15
IUPAC Name5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide
SMILESO=C(NCCc1ccc(F)cc1)c1cnc(N2CCc3ccccc32)cn1
InChIInChI=1S/C21H19FN4O/c22-17-7-5-15(6-8-17)9-11-23-21(27)18-13-25-20(14-24-18)26-12-10-16-3-1-2-4-19(16)26/h1-8,13-14H,9-12H2,(H,23,27)
InChIKeyNCWCJNMDRRFXDD-UHFFFAOYSA-N
XLogP3.28
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.41
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]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

2-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 109172612
5-(2,3-dihydroindol-1-yl)-N-[2-(dimethylamino)ethyl]pyrazine-2-carboxamide
CID 109277176
5-(2,3-dihydroindol-1-yl)-N-[(4-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109280543
5-(2,3-dihydroindol-1-yl)-N-[(4-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109282417
5-(2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109280007
5-(2,3-dihydroindol-1-yl)-N-(4-ethylphenyl)pyrazine-2-carboxamide
CID 109290486
N-cyclopentyl-5-(2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109273970
N-cyclohexyl-5-(2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109274719
2,3-dihydroindol-1-yl-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]methanone
CID 109192418
5-(2,3-dihydroindol-1-yl)-N-(3,4-dimethylphenyl)pyrazine-2-carboxamide
CID 109290481
5-(2,3-dihydroindol-1-yl)-N,N-dipropylpyrazine-2-carboxamide
CID 109288910
5-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109290679

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide?
The IUPAC name of 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide (CID 109284439) is 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide is O=C(NCCc1ccc(F)cc1)c1cnc(N2CCc3ccccc32)cn1.
What is the InChIKey of 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide?
The InChIKey is NCWCJNMDRRFXDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN4O/c22-17-7-5-15(6-8-17)9-11-23-21(27)18-13-25-20(14-24-18)26-12-10-16-3-1-2-4-19(16)26/h1-8,13-14H,9-12H2,(H,23,27).
What are the key properties of 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide?
5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide has a molecular weight of 362.41 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dihydroindol-1-yl)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 109284439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).