[2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone

C20H18ClN3O2 — CID 56879342

IUPAC[2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone
SMILESO=C(c1ccccc1-c1ncc[nH]1)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C20H18ClN3O2/c21-15-7-5-14(6-8-15)18-13-24(11-12-26-18)20(25)17-4-2-1-3-16(17)19-22-9-10-23-19/h1-10,18H,11-13H2,(H,22,23)
InChIKeyDWHFKZLOUIKZJX-UHFFFAOYSA-N
MW367.84 g/mol
LogP3.94
Rot. Bonds3

About [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone

[2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone (PubChem CID 56879342) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone.

Molecular Properties

Compound Name[2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone
PubChem CID56879342
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name[2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone
SMILESO=C(c1ccccc1-c1ncc[nH]1)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C20H18ClN3O2/c21-15-7-5-14(6-8-15)18-13-24(11-12-26-18)20(25)17-4-2-1-3-16(17)19-22-9-10-23-19/h1-10,18H,11-13H2,(H,22,23)
InChIKeyDWHFKZLOUIKZJX-UHFFFAOYSA-N
XLogP3.94
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.84
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone?
The IUPAC name of [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone (CID 56879342) is [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone.
What is the SMILES notation for [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone?
The canonical SMILES for [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone is O=C(c1ccccc1-c1ncc[nH]1)N1CCOC(c2ccc(Cl)cc2)C1.
What is the InChIKey of [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone?
The InChIKey is DWHFKZLOUIKZJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c21-15-7-5-14(6-8-15)18-13-24(11-12-26-18)20(25)17-4-2-1-3-16(17)19-22-9-10-23-19/h1-10,18H,11-13H2,(H,22,23).
What are the key properties of [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone?
[2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone has a molecular weight of 367.84 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chlorophenyl)morpholin-4-yl]-[2-(1H-imidazol-2-yl)phenyl]methanone is sourced from PubChem (CID 56879342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).