imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone

C14H15N3O2 — CID 112725534

IUPACimidazol-1-yl-(2-phenylmorpholin-4-yl)methanone
SMILESO=C(N1CCOC(c2ccccc2)C1)n1ccnc1
InChIInChI=1S/C14H15N3O2/c18-14(17-7-6-15-11-17)16-8-9-19-13(10-16)12-4-2-1-3-5-12/h1-7,11,13H,8-10H2
InChIKeyHMEORDMGNMMLLZ-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.92
Rot. Bonds1

About imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone

imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone (PubChem CID 112725534) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone.

Molecular Properties

Compound Nameimidazol-1-yl-(2-phenylmorpholin-4-yl)methanone
PubChem CID112725534
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Nameimidazol-1-yl-(2-phenylmorpholin-4-yl)methanone
SMILESO=C(N1CCOC(c2ccccc2)C1)n1ccnc1
InChIInChI=1S/C14H15N3O2/c18-14(17-7-6-15-11-17)16-8-9-19-13(10-16)12-4-2-1-3-5-12/h1-7,11,13H,8-10H2
InChIKeyHMEORDMGNMMLLZ-UHFFFAOYSA-N
XLogP1.92
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(4-chlorophenyl)morpholin-4-yl]-imidazol-1-ylmethanone
CID 112732538
morpholin-4-yl-(2-phenylmorpholin-4-yl)methanone
CID 110291317
(2S)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-2-phenylmorpholine-4-carboxamide
CID 97186019
[(2R)-2-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 31414918
(3-phenylimidazol-4-yl)-[(2S)-2-phenylmorpholin-4-yl]methanone
CID 31415200
1-(2-phenylmorpholin-4-yl)but-2-en-1-one
CID 112727078
3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride
CID 119278810
(2S)-1-[(2S)-2-phenylmorpholin-4-yl]-2-(tetrazol-1-yl)propan-1-one
CID 125432054
(3-bromo-2-pyridinyl)-(2-phenylmorpholin-4-yl)methanone
CID 107518605
[(2S)-oxolan-2-yl]-[(2S)-2-phenylmorpholin-4-yl]methanone
CID 51710322
tert-butyl 2-phenylmorpholine-4-carboxylate
CID 58315777
(2S)-2-phenyl-1-[(2S)-2-phenylmorpholin-4-yl]-2-(tetrazol-1-yl)ethanone
CID 96558413

Frequently Asked Questions

What is the IUPAC name of imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone?
The IUPAC name of imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone (CID 112725534) is imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone.
What is the SMILES notation for imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone?
The canonical SMILES for imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone is O=C(N1CCOC(c2ccccc2)C1)n1ccnc1.
What is the InChIKey of imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone?
The InChIKey is HMEORDMGNMMLLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c18-14(17-7-6-15-11-17)16-8-9-19-13(10-16)12-4-2-1-3-5-12/h1-7,11,13H,8-10H2.
What are the key properties of imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone?
imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone has a molecular weight of 257.29 g/mol, XLogP of 1.92, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazol-1-yl-(2-phenylmorpholin-4-yl)methanone is sourced from PubChem (CID 112725534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).