N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide

C23H21N3O2 — CID 25345693

IUPACN-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)N[C@H](Cc1ncc[nH]1)c1ccccc1
InChIInChI=1S/C23H21N3O2/c27-23(16-28-20-11-10-17-6-4-5-9-19(17)14-20)26-21(15-22-24-12-13-25-22)18-7-2-1-3-8-18/h1-14,21H,15-16H2,(H,24,25)(H,26,27)/t21-/m1/s1
InChIKeyXODZPDXASPRAOV-OAQYLSRUSA-N
MW371.44 g/mol
LogP4.04
Rot. Bonds7

About N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide

N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide (PubChem CID 25345693) has the molecular formula C23H21N3O2 and a molecular weight of 371.44 g/mol. Its IUPAC name is N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide
PubChem CID25345693
Molecular FormulaC23H21N3O2
Molecular Weight371.44 g/mol
Exact Mass371.16
IUPAC NameN-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)N[C@H](Cc1ncc[nH]1)c1ccccc1
InChIInChI=1S/C23H21N3O2/c27-23(16-28-20-11-10-17-6-4-5-9-19(17)14-20)26-21(15-22-24-12-13-25-22)18-7-2-1-3-8-18/h1-14,21H,15-16H2,(H,24,25)(H,26,27)/t21-/m1/s1
InChIKeyXODZPDXASPRAOV-OAQYLSRUSA-N
XLogP4.04
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide (CID 25345693) is N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide is O=C(COc1ccc2ccccc2c1)N[C@H](Cc1ncc[nH]1)c1ccccc1.
What is the InChIKey of N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is XODZPDXASPRAOV-OAQYLSRUSA-N. The full InChI is InChI=1S/C23H21N3O2/c27-23(16-28-20-11-10-17-6-4-5-9-19(17)14-20)26-21(15-22-24-12-13-25-22)18-7-2-1-3-8-18/h1-14,21H,15-16H2,(H,24,25)(H,26,27)/t21-/m1/s1.
What are the key properties of N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide?
N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 371.44 g/mol, XLogP of 4.04, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-(1H-imidazol-2-yl)-1-phenylethyl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 25345693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).