N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide

C13H19N3O3 — CID 154859849

IUPACN-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
SMILESO=C(NOC1CCCCO1)C1CCc2cncn2C1
InChIInChI=1S/C13H19N3O3/c17-13(15-19-12-3-1-2-6-18-12)10-4-5-11-7-14-9-16(11)8-10/h7,9-10,12H,1-6,8H2,(H,15,17)
InChIKeyIGFGOWHREFXUIH-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.02
Rot. Bonds3

About N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide

N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide (PubChem CID 154859849) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
PubChem CID154859849
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
SMILESO=C(NOC1CCCCO1)C1CCc2cncn2C1
InChIInChI=1S/C13H19N3O3/c17-13(15-19-12-3-1-2-6-18-12)10-4-5-11-7-14-9-16(11)8-10/h7,9-10,12H,1-6,8H2,(H,15,17)
InChIKeyIGFGOWHREFXUIH-UHFFFAOYSA-N
XLogP1.02
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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CID 130685295
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CID 94824519
1-methyl-N-[(2S)-oxan-2-yl]oxypyrazole-4-carboxamide
CID 94825511
1-methyl-N-(oxan-2-yloxy)pyrazole-4-carboxamide
CID 51103148
(3R)-1-(4-methylbenzoyl)-N-[(2S)-oxan-2-yl]oxypiperidine-3-carboxamide
CID 52828959
N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide
CID 154862278
(2S)-N-[(2S)-oxan-2-yl]oxy-6-oxaspiro[2.5]octane-2-carboxamide
CID 95972380
(3R)-1-(4-fluorophenyl)-N-[(2S)-oxan-2-yl]oxy-5-oxopyrrolidine-3-carboxamide
CID 95300558
(2S)-1-(cyclohexanecarbonyl)-N-[(2S)-oxan-2-yl]oxypyrrolidine-2-carboxamide
CID 95139145
trans-(1R,2R)-2-cyclohexyl-N-[(2R)-oxan-2-yl]oxycyclopropane-1-carboxamide
CID 99716407
N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
CID 154762864
(2R,3R)-3-methyl-N-[(2R)-oxan-2-yl]oxyoxolane-2-carboxamide
CID 97023842

Frequently Asked Questions

What is the IUPAC name of N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide?
The IUPAC name of N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide (CID 154859849) is N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide?
The canonical SMILES for N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide is O=C(NOC1CCCCO1)C1CCc2cncn2C1.
What is the InChIKey of N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide?
The InChIKey is IGFGOWHREFXUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c17-13(15-19-12-3-1-2-6-18-12)10-4-5-11-7-14-9-16(11)8-10/h7,9-10,12H,1-6,8H2,(H,15,17).
What are the key properties of N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide?
N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide has a molecular weight of 265.31 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide is sourced from PubChem (CID 154859849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).