3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide

C23H28N4O2 — CID 70944087

IUPAC3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NC12CC3CC4CC(C1)C4(C3)C2)c1nc(N2CCOCC2)n2ccccc12
InChIInChI=1S/C23H28N4O2/c28-20(25-22-11-15-9-16-10-17(13-22)23(16,12-15)14-22)19-18-3-1-2-4-27(18)21(24-19)26-5-7-29-8-6-26/h1-4,15-17H,5-14H2,(H,25,28)
InChIKeyMOJRSBIDOUBNQB-UHFFFAOYSA-N
MW392.50 g/mol
LogP2.87
Rot. Bonds3

About 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide

3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 70944087) has the molecular formula C23H28N4O2 and a molecular weight of 392.50 g/mol. Its IUPAC name is 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID70944087
Molecular FormulaC23H28N4O2
Molecular Weight392.50 g/mol
Exact Mass392.22
IUPAC Name3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NC12CC3CC4CC(C1)C4(C3)C2)c1nc(N2CCOCC2)n2ccccc12
InChIInChI=1S/C23H28N4O2/c28-20(25-22-11-15-9-16-10-17(13-22)23(16,12-15)14-22)19-18-3-1-2-4-27(18)21(24-19)26-5-7-29-8-6-26/h1-4,15-17H,5-14H2,(H,25,28)
InChIKeyMOJRSBIDOUBNQB-UHFFFAOYSA-N
XLogP2.87
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,2-dimethylpropyl)-3-morpholin-4-ylimidazo[1,5-a]pyridine-1-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 171928250
N-[(2-chlorophenyl)methyl]-3-morpholin-4-ylimidazo[1,5-a]pyridine-1-carboxamide
CID 70944067
N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide
CID 70943994
N-(1-adamantyl)-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 70943990
N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 171930965
N-(1-adamantyl)-3-(2-fluorophenoxy)imidazo[1,5-a]pyridine-1-carboxamide
CID 70944077
N-(1-adamantyl)-3-(1-hydroxypyridin-1-ium-2-yl)imidazo[1,5-a]pyridine-1-carboxamide
CID 136503779
N-(1-adamantyl)-3-(2,3,4-trifluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 171930984
N-(1-adamantyl)-3-methylimidazo[1,5-a]pyridine-1-carboxamide;3-hydroxybenzonitrile
CID 160794891
N-(1,7-dimethyl-5-tricyclo[5.3.1.03,9]undecanyl)-3-(2-morpholin-4-ylethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 71131262
N-(1-adamantyl)-1-methyl-5-morpholin-4-ylpyrazole-4-carboxamide
CID 67020998
N-(1-adamantyl)-1-pyridin-4-ylimidazo[1,5-a]pyridine-3-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 171928969

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 70944087) is 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide is O=C(NC12CC3CC4CC(C1)C4(C3)C2)c1nc(N2CCOCC2)n2ccccc12.
What is the InChIKey of 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is MOJRSBIDOUBNQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O2/c28-20(25-22-11-15-9-16-10-17(13-22)23(16,12-15)14-22)19-18-3-1-2-4-27(18)21(24-19)26-5-7-29-8-6-26/h1-4,15-17H,5-14H2,(H,25,28).
What are the key properties of 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide?
3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 392.50 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-N-(1-tetracyclo[5.3.1.03,9.05,9]undecanyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 70944087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).