3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide

C21H22FN5O2 — CID 109070037

IUPAC3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCN1CCN(C(=O)c2nc(C(=O)Nc3ccccc3F)c3ccccn23)CC1
InChIInChI=1S/C21H22FN5O2/c1-2-25-11-13-26(14-12-25)21(29)19-24-18(17-9-5-6-10-27(17)19)20(28)23-16-8-4-3-7-15(16)22/h3-10H,2,11-14H2,1H3,(H,23,28)
InChIKeyUZQMXKSPDSVXCB-UHFFFAOYSA-N
MW395.44 g/mol
LogP2.50
Rot. Bonds4

About 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide

3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109070037) has the molecular formula C21H22FN5O2 and a molecular weight of 395.44 g/mol. Its IUPAC name is 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109070037
Molecular FormulaC21H22FN5O2
Molecular Weight395.44 g/mol
Exact Mass395.18
IUPAC Name3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCN1CCN(C(=O)c2nc(C(=O)Nc3ccccc3F)c3ccccn23)CC1
InChIInChI=1S/C21H22FN5O2/c1-2-25-11-13-26(14-12-25)21(29)19-24-18(17-9-5-6-10-27(17)19)20(28)23-16-8-4-3-7-15(16)22/h3-10H,2,11-14H2,1H3,(H,23,28)
InChIKeyUZQMXKSPDSVXCB-UHFFFAOYSA-N
XLogP2.50
TPSA69.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.44
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-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

3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109070034
3-(4-ethylpiperazine-1-carbonyl)-N-(pyridin-4-ylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109070021
N-(2-ethoxyphenyl)-3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068537
3-(azepane-1-carbonyl)-N-(2-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071771
3-N-(2-fluorophenyl)-1-N-(2-methylpropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067464
3-(4-methylpiperazine-1-carbonyl)-N-propylimidazo[1,5-a]pyridine-1-carboxamide
CID 109065869
N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109066656
3-N-butyl-1-N-(2-fluorophenyl)-3-N-methylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071542
methyl 2-[[3-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carbonyl]amino]benzoate
CID 109068137
3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109072044
N-(2,4-difluorophenyl)-3-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071656
3-N-(2-fluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109072049

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109070037) is 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide is CCN1CCN(C(=O)c2nc(C(=O)Nc3ccccc3F)c3ccccn23)CC1.
What is the InChIKey of 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is UZQMXKSPDSVXCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22FN5O2/c1-2-25-11-13-26(14-12-25)21(29)19-24-18(17-9-5-6-10-27(17)19)20(28)23-16-8-4-3-7-15(16)22/h3-10H,2,11-14H2,1H3,(H,23,28).
What are the key properties of 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide?
3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 395.44 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109070037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).