2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide

C19H18BrN5O2 — CID 68800264

IUPAC2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide
SMILESO=C(NC1CC1)c1ccc2n1CCN(C(=O)c1cc3ccc(Br)cn3n1)C2
InChIInChI=1S/C19H18BrN5O2/c20-12-1-4-14-9-16(22-25(14)10-12)19(27)23-7-8-24-15(11-23)5-6-17(24)18(26)21-13-2-3-13/h1,4-6,9-10,13H,2-3,7-8,11H2,(H,21,26)
InChIKeyPGWJWEPHJYVFKY-UHFFFAOYSA-N
MW428.29 g/mol
LogP2.45
Rot. Bonds3

About 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide

2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide (PubChem CID 68800264) has the molecular formula C19H18BrN5O2 and a molecular weight of 428.29 g/mol. Its IUPAC name is 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide.

Molecular Properties

Compound Name2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide
PubChem CID68800264
Molecular FormulaC19H18BrN5O2
Molecular Weight428.29 g/mol
Exact Mass427.06
IUPAC Name2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide
SMILESO=C(NC1CC1)c1ccc2n1CCN(C(=O)c1cc3ccc(Br)cn3n1)C2
InChIInChI=1S/C19H18BrN5O2/c20-12-1-4-14-9-16(22-25(14)10-12)19(27)23-7-8-24-15(11-23)5-6-17(24)18(26)21-13-2-3-13/h1,4-6,9-10,13H,2-3,7-8,11H2,(H,21,26)
InChIKeyPGWJWEPHJYVFKY-UHFFFAOYSA-N
XLogP2.45
TPSA71.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.29
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-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 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide?
The IUPAC name of 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide (CID 68800264) is 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide.
What is the SMILES notation for 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide?
The canonical SMILES for 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide is O=C(NC1CC1)c1ccc2n1CCN(C(=O)c1cc3ccc(Br)cn3n1)C2.
What is the InChIKey of 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide?
The InChIKey is PGWJWEPHJYVFKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18BrN5O2/c20-12-1-4-14-9-16(22-25(14)10-12)19(27)23-7-8-24-15(11-23)5-6-17(24)18(26)21-13-2-3-13/h1,4-6,9-10,13H,2-3,7-8,11H2,(H,21,26).
What are the key properties of 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide?
2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide has a molecular weight of 428.29 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromopyrazolo[1,5-a]pyridine-2-carbonyl)-N-cyclopropyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-6-carboxamide is sourced from PubChem (CID 68800264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).