N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide

C15H12ClF3N2O — CID 4188467

IUPACN-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1ncc(C(F)(F)F)cc1Cl
InChIInChI=1S/C15H12ClF3N2O/c16-12-8-11(15(17,18)19)9-20-14(12)21-13(22)7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H,20,21,22)
InChIKeyFHLZDIXRVCTDPO-UHFFFAOYSA-N
MW328.72 g/mol
LogP4.33
Rot. Bonds4

About N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide

N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide (PubChem CID 4188467) has the molecular formula C15H12ClF3N2O and a molecular weight of 328.72 g/mol. Its IUPAC name is N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide
PubChem CID4188467
Molecular FormulaC15H12ClF3N2O
Molecular Weight328.72 g/mol
Exact Mass328.06
IUPAC NameN-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1ncc(C(F)(F)F)cc1Cl
InChIInChI=1S/C15H12ClF3N2O/c16-12-8-11(15(17,18)19)9-20-14(12)21-13(22)7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H,20,21,22)
InChIKeyFHLZDIXRVCTDPO-UHFFFAOYSA-N
XLogP4.33
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.72
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide 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

N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide
CID 143960305
N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-pyridin-2-ylsulfanylacetamide
CID 2464434
N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]acetamide
CID 2800641
N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 4188468
[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-2-oxoethyl] pyridine-2-carboxylate
CID 2376998
[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-2-oxoethyl] 1-benzyl-3,5-dimethylpyrazole-4-carboxylate
CID 35986875
[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-2-oxoethyl] 2-(furan-2-carbonylamino)-3-phenylpropanoate
CID 4179994
[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-2-oxoethyl] 2-methylpropanoate
CID 2404388
[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-2-oxoethyl] 2-[(4-phenylbenzoyl)amino]acetate
CID 2385423
N-[[5-[[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]butanoylamino]sulfamoyl]thiophen-2-yl]methyl]-3-phenylpropanamide
CID 11433417
[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-2-oxoethyl] 3-fluorobenzoate
CID 2385544
[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-2-oxoethyl] pentanoate
CID 2405035

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide?
The IUPAC name of N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide (CID 4188467) is N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide.
What is the SMILES notation for N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide?
The canonical SMILES for N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide is O=C(CCc1ccccc1)Nc1ncc(C(F)(F)F)cc1Cl.
What is the InChIKey of N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide?
The InChIKey is FHLZDIXRVCTDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClF3N2O/c16-12-8-11(15(17,18)19)9-20-14(12)21-13(22)7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H,20,21,22).
What are the key properties of N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide?
N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide has a molecular weight of 328.72 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-phenylpropanamide is sourced from PubChem (CID 4188467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).