2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone

C21H21N3O2 — CID 54562196

IUPAC2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone
SMILESO=C(Cc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1)N1CCOCC1
InChIInChI=1S/C21H21N3O2/c25-19(24-11-13-26-14-12-24)15-18-22-20(16-7-3-1-4-8-16)21(23-18)17-9-5-2-6-10-17/h1-10H,11-15H2,(H,22,23)
InChIKeyZRIRJJNDPKFBIJ-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.14
Rot. Bonds4

About 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone

2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone (PubChem CID 54562196) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone
PubChem CID54562196
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone
SMILESO=C(Cc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1)N1CCOCC1
InChIInChI=1S/C21H21N3O2/c25-19(24-11-13-26-14-12-24)15-18-22-20(16-7-3-1-4-8-16)21(23-18)17-9-5-2-6-10-17/h1-10H,11-15H2,(H,22,23)
InChIKeyZRIRJJNDPKFBIJ-UHFFFAOYSA-N
XLogP3.14
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4,5-diphenyl-1H-imidazol-2-yl)methanol
CID 63926988
1-morpholin-4-yl-2-(2-phenyl-1,3-oxazol-4-yl)ethanone
CID 38549400
4-[4-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butyl]morpholine
CID 154445792
1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one
CID 51088025
6-(2-morpholin-4-yl-2-oxoethyl)pyridine-2-carboxamide
CID 68841111
5-(4,5-diphenyl-1H-imidazol-2-yl)-1-phenylpentan-2-one
CID 91321669
2-(6-ethoxy-2-phenylimidazo[1,2-b]pyridazin-3-yl)-1-morpholin-4-ylethanone
CID 66742848
1-morpholin-4-yl-2-[4-[(4-phenylquinazolin-2-yl)methyl]piperazin-1-yl]ethanone
CID 37269145
1-morpholin-4-yl-3-[3-(4-phenylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one
CID 100762654
2-(3,5-diphenyl-1,2,4-triazol-1-yl)-1-morpholin-4-ylethanone
CID 654746
1-morpholin-4-yl-2-(2-phenylbenzimidazol-1-yl)ethanone
CID 17000579
2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone
CID 3667314

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone (CID 54562196) is 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone is O=C(Cc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1)N1CCOCC1.
What is the InChIKey of 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone?
The InChIKey is ZRIRJJNDPKFBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2/c25-19(24-11-13-26-14-12-24)15-18-22-20(16-7-3-1-4-8-16)21(23-18)17-9-5-2-6-10-17/h1-10H,11-15H2,(H,22,23).
What are the key properties of 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone?
2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone has a molecular weight of 347.42 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone is sourced from PubChem (CID 54562196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).