4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide

C18H10Cl3FN2O — CID 59673665

IUPAC4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccc(-c2ncccc2Cl)c(F)c1
InChIInChI=1S/C18H10Cl3FN2O/c19-11-4-6-16(14(21)9-11)24-18(25)10-3-5-12(15(22)8-10)17-13(20)2-1-7-23-17/h1-9H,(H,24,25)
InChIKeyGBIAKHBFPZRKNF-UHFFFAOYSA-N
MW395.65 g/mol
LogP6.10
Rot. Bonds3

About 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide

4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide (PubChem CID 59673665) has the molecular formula C18H10Cl3FN2O and a molecular weight of 395.65 g/mol. Its IUPAC name is 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide.

Molecular Properties

Compound Name4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide
PubChem CID59673665
Molecular FormulaC18H10Cl3FN2O
Molecular Weight395.65 g/mol
Exact Mass393.98
IUPAC Name4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccc(-c2ncccc2Cl)c(F)c1
InChIInChI=1S/C18H10Cl3FN2O/c19-11-4-6-16(14(21)9-11)24-18(25)10-3-5-12(15(22)8-10)17-13(20)2-1-7-23-17/h1-9H,(H,24,25)
InChIKeyGBIAKHBFPZRKNF-UHFFFAOYSA-N
XLogP6.10
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.65
LogP ≤ 56.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetamidophenyl)-4-(3-chloro-2-pyridinyl)-3-fluorobenzamide
CID 59673213
4-(3-chloro-2-pyridinyl)-3-fluorobenzoic acid
CID 69201249
4-(3-chloro-2-pyridinyl)-N-cyclopropyl-3-fluorobenzamide
CID 59672610
N-(1,3-benzodioxol-5-yl)-4-(3-chloro-2-pyridinyl)-3-fluorobenzamide
CID 59673739
4-(3-chloro-2-pyridinyl)-N-[(3,4-dichlorophenyl)methyl]-3-fluorobenzamide
CID 59672600
N-(2-chloro-4-fluorophenyl)-3,4-difluorobenzamide
CID 30431388
2-bromo-N-(2,4-dichlorophenyl)pyridine-3-carboxamide
CID 113255485
N-(2,4-dichlorophenyl)-2-(4-fluorophenoxy)pyridine-3-carboxamide
CID 612195
N-(4-chloro-2-fluorophenyl)-3,4-difluorobenzamide
CID 30430307
3-amino-4-chloro-N-(2,4-dichlorophenyl)benzamide
CID 20551991
2-cyano-N-(2,4-dichlorophenyl)pyridine-4-carboxamide
CID 112523952
2,6-dichloro-N-(2,4-dichlorophenyl)benzamide
CID 3637585

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide?
The IUPAC name of 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide (CID 59673665) is 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide.
What is the SMILES notation for 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide?
The canonical SMILES for 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide is O=C(Nc1ccc(Cl)cc1Cl)c1ccc(-c2ncccc2Cl)c(F)c1.
What is the InChIKey of 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide?
The InChIKey is GBIAKHBFPZRKNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10Cl3FN2O/c19-11-4-6-16(14(21)9-11)24-18(25)10-3-5-12(15(22)8-10)17-13(20)2-1-7-23-17/h1-9H,(H,24,25).
What are the key properties of 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide?
4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide has a molecular weight of 395.65 g/mol, XLogP of 6.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-2-pyridinyl)-N-(2,4-dichlorophenyl)-3-fluorobenzamide is sourced from PubChem (CID 59673665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).