3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide

C22H26N4O2 — CID 110612966

IUPAC3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)Cc1nc(C(=O)Nc2cccc(N3CCOCC3)c2)c2ccccn12
InChIInChI=1S/C22H26N4O2/c1-16(2)14-20-24-21(19-8-3-4-9-26(19)20)22(27)23-17-6-5-7-18(15-17)25-10-12-28-13-11-25/h3-9,15-16H,10-14H2,1-2H3,(H,23,27)
InChIKeyRSQXJUDGCAMISX-UHFFFAOYSA-N
MW378.48 g/mol
LogP3.62
Rot. Bonds5

About 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide

3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 110612966) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID110612966
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC Name3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)Cc1nc(C(=O)Nc2cccc(N3CCOCC3)c2)c2ccccn12
InChIInChI=1S/C22H26N4O2/c1-16(2)14-20-24-21(19-8-3-4-9-26(19)20)22(27)23-17-6-5-7-18(15-17)25-10-12-28-13-11-25/h3-9,15-16H,10-14H2,1-2H3,(H,23,27)
InChIKeyRSQXJUDGCAMISX-UHFFFAOYSA-N
XLogP3.62
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 110612966) is 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide is CC(C)Cc1nc(C(=O)Nc2cccc(N3CCOCC3)c2)c2ccccn12.
What is the InChIKey of 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is RSQXJUDGCAMISX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-16(2)14-20-24-21(19-8-3-4-9-26(19)20)22(27)23-17-6-5-7-18(15-17)25-10-12-28-13-11-25/h3-9,15-16H,10-14H2,1-2H3,(H,23,27).
What are the key properties of 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide?
3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 378.48 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropyl)-N-(3-morpholin-4-ylphenyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 110612966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).