2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide

C13H13F2N3O — CID 115686762

IUPAC2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
SMILESO=C(Cc1c(F)cccc1F)NCCc1ncc[nH]1
InChIInChI=1S/C13H13F2N3O/c14-10-2-1-3-11(15)9(10)8-13(19)18-5-4-12-16-6-7-17-12/h1-3,6-7H,4-5,8H2,(H,16,17)(H,18,19)
InChIKeyXRNZWWKDKKWQSQ-UHFFFAOYSA-N
MW265.26 g/mol
LogP1.59
Rot. Bonds5

About 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide

2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide (PubChem CID 115686762) has the molecular formula C13H13F2N3O and a molecular weight of 265.26 g/mol. Its IUPAC name is 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
PubChem CID115686762
Molecular FormulaC13H13F2N3O
Molecular Weight265.26 g/mol
Exact Mass265.10
IUPAC Name2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
SMILESO=C(Cc1c(F)cccc1F)NCCc1ncc[nH]1
InChIInChI=1S/C13H13F2N3O/c14-10-2-1-3-11(15)9(10)8-13(19)18-5-4-12-16-6-7-17-12/h1-3,6-7H,4-5,8H2,(H,16,17)(H,18,19)
InChIKeyXRNZWWKDKKWQSQ-UHFFFAOYSA-N
XLogP1.59
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.26
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-fluoro-N-[2-(1H-imidazol-2-yl)ethyl]benzamide
CID 115620189
N-[2-(1H-imidazol-2-yl)ethyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 115620119
2-(2-aminophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 113315085
2,4,6-trifluoro-N-[2-(1H-imidazol-2-yl)ethyl]benzamide
CID 115668718
2-(3-fluoro-4-methoxyphenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 115668455
N-[2-(1H-imidazol-2-yl)ethyl]-2-(3-methoxyphenyl)acetamide
CID 115620121
2-(3,4-dichlorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 115649653
N-[2-[2-(1H-imidazol-2-yl)ethylamino]-2-oxoethyl]benzamide
CID 115620128
2-fluoro-N-[2-(1H-imidazol-2-yl)ethyl]-5-methylbenzamide
CID 113247173
ethane;N-[2-(1H-imidazol-2-yl)ethyl]propanamide
CID 143717261
2-(4-acetamidophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide
CID 115620125
N-[2-(1H-imidazol-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 115620327

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide (CID 115686762) is 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide is O=C(Cc1c(F)cccc1F)NCCc1ncc[nH]1.
What is the InChIKey of 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide?
The InChIKey is XRNZWWKDKKWQSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F2N3O/c14-10-2-1-3-11(15)9(10)8-13(19)18-5-4-12-16-6-7-17-12/h1-3,6-7H,4-5,8H2,(H,16,17)(H,18,19).
What are the key properties of 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide?
2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide has a molecular weight of 265.26 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluorophenyl)-N-[2-(1H-imidazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 115686762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).