2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide

C12H12ClN3O — CID 82559154

IUPAC2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide
SMILESCC(C(N)=O)n1ccnc1-c1ccccc1Cl
InChIInChI=1S/C12H12ClN3O/c1-8(11(14)17)16-7-6-15-12(16)9-4-2-3-5-10(9)13/h2-8H,1H3,(H2,14,17)
InChIKeyUUEHYRGQLYAARJ-UHFFFAOYSA-N
MW249.70 g/mol
LogP2.25
Rot. Bonds3

About 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide

2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide (PubChem CID 82559154) has the molecular formula C12H12ClN3O and a molecular weight of 249.70 g/mol. Its IUPAC name is 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide.

Molecular Properties

Compound Name2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide
PubChem CID82559154
Molecular FormulaC12H12ClN3O
Molecular Weight249.70 g/mol
Exact Mass249.07
IUPAC Name2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide
SMILESCC(C(N)=O)n1ccnc1-c1ccccc1Cl
InChIInChI=1S/C12H12ClN3O/c1-8(11(14)17)16-7-6-15-12(16)9-4-2-3-5-10(9)13/h2-8H,1H3,(H2,14,17)
InChIKeyUUEHYRGQLYAARJ-UHFFFAOYSA-N
XLogP2.25
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.70
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide 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

2-[2-(3-methylphenyl)imidazol-1-yl]propanamide
CID 82559003
methyl 2-[2-(2-fluorophenyl)imidazol-1-yl]propanoate
CID 82561191
2-[2-(3,5-difluorophenyl)imidazol-1-yl]propanamide
CID 82559835
(2S)-2-[2-(2,3-dichloro-4-methylphenyl)imidazol-1-yl]-3-methylbutanamide
CID 56867164
2-[2-(3-phenylpropyl)imidazol-1-yl]propanamide
CID 82558306
(2S)-2-[2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]imidazol-1-yl]propanamide
CID 56880216
methyl 2-[2-(4-chlorophenyl)imidazol-1-yl]propanoate
CID 82561216
N-[[5-(2-chlorophenyl)-1,2-oxazol-3-yl]methyl]-2-(2-methylimidazol-1-yl)propanamide
CID 56750539
2-(2,5-dichloropyrrol-1-yl)propanamide
CID 23453202
2-[[4-amino-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropylpropanamide
CID 78457593
2-(2-chlorophenyl)-1-(4-chlorophenyl)imidazole;N-(3-ethylhexan-2-yl)acetamide
CID 143123914
3-(2-chlorophenyl)-1-propan-2-ylpyrrole-2-carboxylic acid
CID 117222652

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide?
The IUPAC name of 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide (CID 82559154) is 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide.
What is the SMILES notation for 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide?
The canonical SMILES for 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide is CC(C(N)=O)n1ccnc1-c1ccccc1Cl.
What is the InChIKey of 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide?
The InChIKey is UUEHYRGQLYAARJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3O/c1-8(11(14)17)16-7-6-15-12(16)9-4-2-3-5-10(9)13/h2-8H,1H3,(H2,14,17).
What are the key properties of 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide?
2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide has a molecular weight of 249.70 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenyl)imidazol-1-yl]propanamide is sourced from PubChem (CID 82559154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).