N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide

C14H10Cl2FNO2 — CID 27844181

IUPACN-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1F
InChIInChI=1S/C14H10Cl2FNO2/c1-20-13-3-2-8(4-12(13)17)14(19)18-11-6-9(15)5-10(16)7-11/h2-7H,1H3,(H,18,19)
InChIKeyVLICSSHIGUTPNA-UHFFFAOYSA-N
MW314.14 g/mol
LogP4.39
Rot. Bonds3

About N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide

N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide (PubChem CID 27844181) has the molecular formula C14H10Cl2FNO2 and a molecular weight of 314.14 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide
PubChem CID27844181
Molecular FormulaC14H10Cl2FNO2
Molecular Weight314.14 g/mol
Exact Mass313.01
IUPAC NameN-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1F
InChIInChI=1S/C14H10Cl2FNO2/c1-20-13-3-2-8(4-12(13)17)14(19)18-11-6-9(15)5-10(16)7-11/h2-7H,1H3,(H,18,19)
InChIKeyVLICSSHIGUTPNA-UHFFFAOYSA-N
XLogP4.39
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.14
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(3-chloro-5-fluorophenyl)-4-methoxybenzamide
CID 107363446
N-(4-aminophenyl)-3-fluoro-4-methoxybenzamide
CID 55125214
(3,5-dichlorophenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 24723233
N-[5-chloro-2-(dimethylamino)phenyl]-3-fluoro-4-methoxybenzamide
CID 78807126
N-(3,5-dichlorophenyl)-3,5-dimethoxy-4-methylbenzamide
CID 4830381
3-fluoro-4-methoxy-N-pyridin-3-ylbenzamide
CID 25343484
N-(4-amino-2-chlorophenyl)-3-fluoro-4-methoxybenzamide
CID 62918843
(4-chlorophenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 2757552
N-(5-chloropyrazin-2-yl)-3-fluoro-4-methoxybenzamide
CID 104964229
N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide
CID 7336959
N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 68786791
N-(3-fluoro-4-methoxyphenyl)-4-hydroxy-3-methylbenzamide
CID 103951806

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide?
The IUPAC name of N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide (CID 27844181) is N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide is COc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1F.
What is the InChIKey of N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide?
The InChIKey is VLICSSHIGUTPNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2FNO2/c1-20-13-3-2-8(4-12(13)17)14(19)18-11-6-9(15)5-10(16)7-11/h2-7H,1H3,(H,18,19).
What are the key properties of N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide?
N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide has a molecular weight of 314.14 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide is sourced from PubChem (CID 27844181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).