(2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide

C24H21N3O2 — CID 122234471

IUPAC(2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide
SMILESC[C@@H](Oc1ccc(-n2ccnc2)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H21N3O2/c1-18(29-23-13-11-22(12-14-23)27-16-15-25-17-27)24(28)26-21-9-7-20(8-10-21)19-5-3-2-4-6-19/h2-18H,1H3,(H,26,28)/t18-/m1/s1
InChIKeyXIVVXPYPHPFFPR-GOSISDBHSA-N
MW383.45 g/mol
LogP4.95
Rot. Bonds6

About (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide

(2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide (PubChem CID 122234471) has the molecular formula C24H21N3O2 and a molecular weight of 383.45 g/mol. Its IUPAC name is (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide
PubChem CID122234471
Molecular FormulaC24H21N3O2
Molecular Weight383.45 g/mol
Exact Mass383.16
IUPAC Name(2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide
SMILESC[C@@H](Oc1ccc(-n2ccnc2)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H21N3O2/c1-18(29-23-13-11-22(12-14-23)27-16-15-25-17-27)24(28)26-21-9-7-20(8-10-21)19-5-3-2-4-6-19/h2-18H,1H3,(H,26,28)/t18-/m1/s1
InChIKeyXIVVXPYPHPFFPR-GOSISDBHSA-N
XLogP4.95
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide?
The IUPAC name of (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide (CID 122234471) is (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide.
What is the SMILES notation for (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide?
The canonical SMILES for (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide is C[C@@H](Oc1ccc(-n2ccnc2)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide?
The InChIKey is XIVVXPYPHPFFPR-GOSISDBHSA-N. The full InChI is InChI=1S/C24H21N3O2/c1-18(29-23-13-11-22(12-14-23)27-16-15-25-17-27)24(28)26-21-9-7-20(8-10-21)19-5-3-2-4-6-19/h2-18H,1H3,(H,26,28)/t18-/m1/s1.
What are the key properties of (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide?
(2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide has a molecular weight of 383.45 g/mol, XLogP of 4.95, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-imidazol-1-ylphenoxy)-N-(4-phenylphenyl)propanamide is sourced from PubChem (CID 122234471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).