N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide

C15H11Cl2F3N2O — CID 2766744

IUPACN-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide
SMILESCC(C(=O)Nc1ccc(Cl)cc1)c1ncc(C(F)(F)F)cc1Cl
InChIInChI=1S/C15H11Cl2F3N2O/c1-8(14(23)22-11-4-2-10(16)3-5-11)13-12(17)6-9(7-21-13)15(18,19)20/h2-8H,1H3,(H,22,23)
InChIKeyZBHSNQDGAVFNCQ-UHFFFAOYSA-N
MW363.17 g/mol
LogP5.15
Rot. Bonds3

About N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide

N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide (PubChem CID 2766744) has the molecular formula C15H11Cl2F3N2O and a molecular weight of 363.17 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide
PubChem CID2766744
Molecular FormulaC15H11Cl2F3N2O
Molecular Weight363.17 g/mol
Exact Mass362.02
IUPAC NameN-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide
SMILESCC(C(=O)Nc1ccc(Cl)cc1)c1ncc(C(F)(F)F)cc1Cl
InChIInChI=1S/C15H11Cl2F3N2O/c1-8(14(23)22-11-4-2-10(16)3-5-11)13-12(17)6-9(7-21-13)15(18,19)20/h2-8H,1H3,(H,22,23)
InChIKeyZBHSNQDGAVFNCQ-UHFFFAOYSA-N
XLogP5.15
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.17
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Fluopyram
CID 11158353
Ica-27243
CID 9903497
Ztz240
CID 3780776
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CID 1472407
N-(4-chloro-3-(trifluoromethyl)phenyl)picolinamide
CID 8403638
2-(2-chloro-6-fluorophenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 839135
N-[4-chloro-3-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 882134
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-cyclopropylacetamide
CID 1491758

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide?
The IUPAC name of N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide (CID 2766744) is N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide is CC(C(=O)Nc1ccc(Cl)cc1)c1ncc(C(F)(F)F)cc1Cl.
What is the InChIKey of N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide?
The InChIKey is ZBHSNQDGAVFNCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2F3N2O/c1-8(14(23)22-11-4-2-10(16)3-5-11)13-12(17)6-9(7-21-13)15(18,19)20/h2-8H,1H3,(H,22,23).
What are the key properties of N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide?
N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide has a molecular weight of 363.17 g/mol, XLogP of 5.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanamide is sourced from PubChem (CID 2766744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).