(4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone

C13H14N4O2 — CID 71801444

IUPAC(4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone
SMILESO=C(c1cc(-n2ccnc2)ccn1)N1CCOCC1
InChIInChI=1S/C13H14N4O2/c18-13(16-5-7-19-8-6-16)12-9-11(1-2-15-12)17-4-3-14-10-17/h1-4,9-10H,5-8H2
InChIKeyANNAEYIJOJERHI-UHFFFAOYSA-N
MW258.28 g/mol
LogP0.74
Rot. Bonds2

About (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone

(4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone (PubChem CID 71801444) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone
PubChem CID71801444
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name(4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone
SMILESO=C(c1cc(-n2ccnc2)ccn1)N1CCOCC1
InChIInChI=1S/C13H14N4O2/c18-13(16-5-7-19-8-6-16)12-9-11(1-2-15-12)17-4-3-14-10-17/h1-4,9-10H,5-8H2
InChIKeyANNAEYIJOJERHI-UHFFFAOYSA-N
XLogP0.74
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-(4-morpholin-4-ylpyridine-2-carbonyl)piperazin-1-yl]ethanone
CID 109206574
[(3S)-3-anilinopiperidin-1-yl]-(4-imidazol-1-yl-2-pyridinyl)methanone
CID 97260124
(4-phenylpiperazin-1-yl)-(4-pyrrol-1-yl-2-pyridinyl)methanone
CID 71801413
[4-[4-(dimethylamino)anilino]-2-pyridinyl]-morpholin-4-ylmethanone
CID 109206522
[4-[(1R,6S)-9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl]-2-pyridinyl]-morpholin-4-ylmethanone
CID 56898986
[2-[4-(morpholine-4-carbonyl)-2-pyridinyl]-4-pyridinyl]-morpholin-4-ylmethanone
CID 171623322
1-[4-[[2-(morpholine-4-carbonyl)-4-pyridinyl]amino]phenyl]ethanone
CID 109206514
morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone
CID 109082844
[4-[(3R)-3-(2-methylpropyl)pyrrolidin-1-yl]-2-pyridinyl]-morpholin-4-ylmethanone
CID 95724039
[4-(3-methoxypiperidin-1-yl)-2-pyridinyl]-morpholin-4-ylmethanone
CID 56886009
[(3R,4R)-3-hydroxy-4-(1-methylpyrazol-4-yl)oxypyrrolidin-1-yl]-(4-imidazol-1-yl-2-pyridinyl)methanone
CID 167922775
N-(2-methylpropyl)-2-(morpholine-4-carbonyl)pyridine-4-carboxamide
CID 109079570

Frequently Asked Questions

What is the IUPAC name of (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone?
The IUPAC name of (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone (CID 71801444) is (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone?
The canonical SMILES for (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone is O=C(c1cc(-n2ccnc2)ccn1)N1CCOCC1.
What is the InChIKey of (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone?
The InChIKey is ANNAEYIJOJERHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c18-13(16-5-7-19-8-6-16)12-9-11(1-2-15-12)17-4-3-14-10-17/h1-4,9-10H,5-8H2.
What are the key properties of (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone?
(4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone has a molecular weight of 258.28 g/mol, XLogP of 0.74, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-imidazol-1-yl-2-pyridinyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 71801444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).