2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide

C17H17N3O2 — CID 82251501

IUPAC2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide
SMILESO=C(COc1ccc(C2=NCCN2)cc1)Nc1ccccc1
InChIInChI=1S/C17H17N3O2/c21-16(20-14-4-2-1-3-5-14)12-22-15-8-6-13(7-9-15)17-18-10-11-19-17/h1-9H,10-12H2,(H,18,19)(H,20,21)
InChIKeyVHHJMPXCBTTZEA-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.05
Rot. Bonds5

About 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide

2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide (PubChem CID 82251501) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide
PubChem CID82251501
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide
SMILESO=C(COc1ccc(C2=NCCN2)cc1)Nc1ccccc1
InChIInChI=1S/C17H17N3O2/c21-16(20-14-4-2-1-3-5-14)12-22-15-8-6-13(7-9-15)17-18-10-11-19-17/h1-9H,10-12H2,(H,18,19)(H,20,21)
InChIKeyVHHJMPXCBTTZEA-UHFFFAOYSA-N
XLogP2.05
TPSA62.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide?
The IUPAC name of 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide (CID 82251501) is 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide.
What is the SMILES notation for 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide?
The canonical SMILES for 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide is O=C(COc1ccc(C2=NCCN2)cc1)Nc1ccccc1.
What is the InChIKey of 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide?
The InChIKey is VHHJMPXCBTTZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c21-16(20-14-4-2-1-3-5-14)12-22-15-8-6-13(7-9-15)17-18-10-11-19-17/h1-9H,10-12H2,(H,18,19)(H,20,21).
What are the key properties of 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide?
2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide has a molecular weight of 295.34 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]-N-phenylacetamide is sourced from PubChem (CID 82251501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).