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

C20H20N4O4 — CID 109069342

IUPACN-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2nc(C(=O)N3CCOCC3)c3ccccn23)c1
InChIInChI=1S/C20H20N4O4/c1-27-15-6-4-5-14(13-15)21-19(25)18-22-17(16-7-2-3-8-24(16)18)20(26)23-9-11-28-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,25)
InChIKeyHQSLHBGRNRNNGU-UHFFFAOYSA-N
MW380.40 g/mol
LogP2.07
Rot. Bonds4

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

N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109069342) has the molecular formula C20H20N4O4 and a molecular weight of 380.40 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109069342
Molecular FormulaC20H20N4O4
Molecular Weight380.40 g/mol
Exact Mass380.15
IUPAC NameN-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2nc(C(=O)N3CCOCC3)c3ccccn23)c1
InChIInChI=1S/C20H20N4O4/c1-27-15-6-4-5-14(13-15)21-19(25)18-22-17(16-7-2-3-8-24(16)18)20(26)23-9-11-28-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,25)
InChIKeyHQSLHBGRNRNNGU-UHFFFAOYSA-N
XLogP2.07
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.40
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 109069342) is N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is COc1cccc(NC(=O)c2nc(C(=O)N3CCOCC3)c3ccccn23)c1.
What is the InChIKey of N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is HQSLHBGRNRNNGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O4/c1-27-15-6-4-5-14(13-15)21-19(25)18-22-17(16-7-2-3-8-24(16)18)20(26)23-9-11-28-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,25).
What are the key properties of N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 380.40 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109069342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).