2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide

C14H15Cl2N3O2 — CID 51087075

IUPAC2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide
SMILESCC(Cn1ccnc1)NC(=O)COc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H15Cl2N3O2/c1-10(7-19-5-4-17-9-19)18-14(20)8-21-11-2-3-12(15)13(16)6-11/h2-6,9-10H,7-8H2,1H3,(H,18,20)
InChIKeyHASTUZYLWKPQLM-UHFFFAOYSA-N
MW328.20 g/mol
LogP2.77
Rot. Bonds6

About 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide

2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide (PubChem CID 51087075) has the molecular formula C14H15Cl2N3O2 and a molecular weight of 328.20 g/mol. Its IUPAC name is 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide
PubChem CID51087075
Molecular FormulaC14H15Cl2N3O2
Molecular Weight328.20 g/mol
Exact Mass327.05
IUPAC Name2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide
SMILESCC(Cn1ccnc1)NC(=O)COc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H15Cl2N3O2/c1-10(7-19-5-4-17-9-19)18-14(20)8-21-11-2-3-12(15)13(16)6-11/h2-6,9-10H,7-8H2,1H3,(H,18,20)
InChIKeyHASTUZYLWKPQLM-UHFFFAOYSA-N
XLogP2.77
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.20
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chloro-2-methylphenoxy)-N-(3-imidazol-1-ylpropyl)propanamide
CID 3310979
2-(4-chlorophenoxy)-N-[2-(1H-imidazol-5-yl)ethyl]acetamide
CID 17579887
2-(4-chlorophenoxy)-N-[3-(1H-imidazol-1-yl)propyl]-2-methylpropanamide
CID 645577
2-(4-chlorophenoxy)-N-[3-(1H-imidazol-1-yl)propyl]propanamide
CID 6618778
2-(4-Fluoro-phenoxy)-N-(3-imidazol-1-yl-propyl)-acetamide
CID 24793362
1-[2-(3,4-dichlorophenoxy)ethyl]-1H-imidazole oxalate
CID 2923973
N-(3-(1H-imidazol-1-yl)propyl)-2-(2,4-dichlorophenoxy)acetamide hydrochloride
CID 6603441
1-[2-(3-chlorophenoxy)ethyl]-1H-imidazole hydrochloride
CID 2847300
N-(3-Imidazol-1-yl-propyl)-2-(4-methoxy-phenoxy)-acetamide
CID 16682262
N-[3-(1H-imidazol-1-yl)propyl]-2-phenoxyacetamide
CID 5081968
1H-Imidazole, 2-((3,4-dichlorophenoxy)methyl)-, monohydrochloride
CID 206193
2-(4-chloro-2-methylphenoxy)-N-[3-(1H-imidazol-1-yl)propyl]acetamide
CID 2933364

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide?
The IUPAC name of 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide (CID 51087075) is 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide?
The canonical SMILES for 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide is CC(Cn1ccnc1)NC(=O)COc1ccc(Cl)c(Cl)c1.
What is the InChIKey of 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide?
The InChIKey is HASTUZYLWKPQLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2N3O2/c1-10(7-19-5-4-17-9-19)18-14(20)8-21-11-2-3-12(15)13(16)6-11/h2-6,9-10H,7-8H2,1H3,(H,18,20).
What are the key properties of 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide?
2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide has a molecular weight of 328.20 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenoxy)-N-(1-imidazol-1-ylpropan-2-yl)acetamide is sourced from PubChem (CID 51087075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).