N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide

C14H12ClFN2O — CID 129287438

IUPACN-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide
SMILESCC(=O)N(c1ccc(Cl)c(F)c1)c1cnccc1C
InChIInChI=1S/C14H12ClFN2O/c1-9-5-6-17-8-14(9)18(10(2)19)11-3-4-12(15)13(16)7-11/h3-8H,1-2H3
InChIKeySUYXOVSOGWUVTO-UHFFFAOYSA-N
MW278.71 g/mol
LogP3.87
Rot. Bonds2

About N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide

N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide (PubChem CID 129287438) has the molecular formula C14H12ClFN2O and a molecular weight of 278.71 g/mol. Its IUPAC name is N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide
PubChem CID129287438
Molecular FormulaC14H12ClFN2O
Molecular Weight278.71 g/mol
Exact Mass278.06
IUPAC NameN-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide
SMILESCC(=O)N(c1ccc(Cl)c(F)c1)c1cnccc1C
InChIInChI=1S/C14H12ClFN2O/c1-9-5-6-17-8-14(9)18(10(2)19)11-3-4-12(15)13(16)7-11/h3-8H,1-2H3
InChIKeySUYXOVSOGWUVTO-UHFFFAOYSA-N
XLogP3.87
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.71
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide?
The IUPAC name of N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide (CID 129287438) is N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide?
The canonical SMILES for N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide is CC(=O)N(c1ccc(Cl)c(F)c1)c1cnccc1C.
What is the InChIKey of N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide?
The InChIKey is SUYXOVSOGWUVTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClFN2O/c1-9-5-6-17-8-14(9)18(10(2)19)11-3-4-12(15)13(16)7-11/h3-8H,1-2H3.
What are the key properties of N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide?
N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide has a molecular weight of 278.71 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 129287438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).