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

C22H25N5O2 — CID 109070034

IUPAC3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCN1CCN(C(=O)c2nc(C(=O)Nc3cccc(C)c3)c3ccccn23)CC1
InChIInChI=1S/C22H25N5O2/c1-3-25-11-13-26(14-12-25)22(29)20-24-19(18-9-4-5-10-27(18)20)21(28)23-17-8-6-7-16(2)15-17/h4-10,15H,3,11-14H2,1-2H3,(H,23,28)
InChIKeyLEQNGSMUGCBXIB-UHFFFAOYSA-N
MW391.48 g/mol
LogP2.67
Rot. Bonds4

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

3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109070034) has the molecular formula C22H25N5O2 and a molecular weight of 391.48 g/mol. Its IUPAC name is 3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109070034
Molecular FormulaC22H25N5O2
Molecular Weight391.48 g/mol
Exact Mass391.20
IUPAC Name3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCN1CCN(C(=O)c2nc(C(=O)Nc3cccc(C)c3)c3ccccn23)CC1
InChIInChI=1S/C22H25N5O2/c1-3-25-11-13-26(14-12-25)22(29)20-24-19(18-9-4-5-10-27(18)20)21(28)23-17-8-6-7-16(2)15-17/h4-10,15H,3,11-14H2,1-2H3,(H,23,28)
InChIKeyLEQNGSMUGCBXIB-UHFFFAOYSA-N
XLogP2.67
TPSA69.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.48
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-ethylpiperazine-1-carbonyl)-N-(2-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109070037
3-(4-ethylpiperazine-1-carbonyl)-N-(pyridin-4-ylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109070021
3-N-(3-methylphenyl)-1-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071926
1-N-(3,4-dimethylphenyl)-3-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071931
3-(4-formylpiperazine-1-carbonyl)-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109070084
1-N-(3-methylphenyl)-3-N-[(3-methylphenyl)methyl]imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070366
3-N-butyl-3-N-methyl-1-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071524
3-N-cyclohexyl-1-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068661
N-(3-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068818
3-(azepane-1-carbonyl)-N-(2,4-dimethylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071760
N-(3,5-dimethylphenyl)-3-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071641
N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109066656

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109070034) is 3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide is CCN1CCN(C(=O)c2nc(C(=O)Nc3cccc(C)c3)c3ccccn23)CC1.
What is the InChIKey of 3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is LEQNGSMUGCBXIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O2/c1-3-25-11-13-26(14-12-25)22(29)20-24-19(18-9-4-5-10-27(18)20)21(28)23-17-8-6-7-16(2)15-17/h4-10,15H,3,11-14H2,1-2H3,(H,23,28).
What are the key properties of 3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide?
3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 391.48 g/mol, XLogP of 2.67, 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-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109070034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).