(2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide

C10H8Cl2F3NO — CID 2396545

IUPAC(2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide
SMILESC[C@@H](Cl)C(=O)Nc1cc(C(F)(F)F)ccc1Cl
InChIInChI=1S/C10H8Cl2F3NO/c1-5(11)9(17)16-8-4-6(10(13,14)15)2-3-7(8)12/h2-5H,1H3,(H,16,17)/t5-/m1/s1
InChIKeyGVZJPYFBHFOGLJ-RXMQYKEDSA-N
MW286.08 g/mol
LogP3.92
Rot. Bonds2

About (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide

(2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide (PubChem CID 2396545) has the molecular formula C10H8Cl2F3NO and a molecular weight of 286.08 g/mol. Its IUPAC name is (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name(2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide
PubChem CID2396545
Molecular FormulaC10H8Cl2F3NO
Molecular Weight286.08 g/mol
Exact Mass284.99
IUPAC Name(2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide
SMILESC[C@@H](Cl)C(=O)Nc1cc(C(F)(F)F)ccc1Cl
InChIInChI=1S/C10H8Cl2F3NO/c1-5(11)9(17)16-8-4-6(10(13,14)15)2-3-7(8)12/h2-5H,1H3,(H,16,17)/t5-/m1/s1
InChIKeyGVZJPYFBHFOGLJ-RXMQYKEDSA-N
XLogP3.92
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.08
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]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-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methylbutanamide
CID 24690259
4-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methylbutanamide
CID 80542425
2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide
CID 4117637
(2R)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylsulfanylpropanamide
CID 7820937
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenoxypropanamide
CID 3259116
2-(aminomethyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]butanamide
CID 65225734
(2S)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-methylphenoxy)propanamide
CID 1019991
(2R)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-methylphenyl)sulfanylpropanamide
CID 2198317
1-[2-chloro-5-(trifluoromethyl)phenyl]-3-(1-phenylethyl)urea
CID 17087713
N-[2-chloro-5-(trifluoromethyl)phenyl]-4-(2-methylpropanoylamino)benzamide
CID 1214413
[(2S)-1-[2-chloro-5-(trifluoromethyl)anilino]-1-oxopropan-2-yl] cyclopropanecarboxylate
CID 2358382
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(3,4-dimethylphenoxy)propanamide
CID 53266514

Frequently Asked Questions

What is the IUPAC name of (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide (CID 2396545) is (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide is C[C@@H](Cl)C(=O)Nc1cc(C(F)(F)F)ccc1Cl.
What is the InChIKey of (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide?
The InChIKey is GVZJPYFBHFOGLJ-RXMQYKEDSA-N. The full InChI is InChI=1S/C10H8Cl2F3NO/c1-5(11)9(17)16-8-4-6(10(13,14)15)2-3-7(8)12/h2-5H,1H3,(H,16,17)/t5-/m1/s1.
What are the key properties of (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide?
(2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide has a molecular weight of 286.08 g/mol, XLogP of 3.92, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 2396545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).