N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide

C15H13ClFNO2 — CID 79770618

IUPACN-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc(C)cc1F
InChIInChI=1S/C15H13ClFNO2/c1-9-3-5-11(12(17)7-9)15(19)18-13-8-10(16)4-6-14(13)20-2/h3-8H,1-2H3,(H,18,19)
InChIKeyZPHLLNWCHHBKON-UHFFFAOYSA-N
MW293.73 g/mol
LogP4.05
Rot. Bonds3

About N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide

N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide (PubChem CID 79770618) has the molecular formula C15H13ClFNO2 and a molecular weight of 293.73 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide
PubChem CID79770618
Molecular FormulaC15H13ClFNO2
Molecular Weight293.73 g/mol
Exact Mass293.06
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc(C)cc1F
InChIInChI=1S/C15H13ClFNO2/c1-9-3-5-11(12(17)7-9)15(19)18-13-8-10(16)4-6-14(13)20-2/h3-8H,1-2H3,(H,18,19)
InChIKeyZPHLLNWCHHBKON-UHFFFAOYSA-N
XLogP4.05
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.73
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 79770803
4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide
CID 26688337
N-(2-bromo-5-chlorophenyl)-2-methoxy-5-methylbenzamide
CID 81272413
2,5-dichloro-N-(2-methoxy-5-methylphenyl)benzamide
CID 965623
4-chloro-N-(5-chloro-2-methoxyphenyl)-2-hydroxybenzamide
CID 29286691
N-(5-bromo-2-methoxyphenyl)-2-fluoro-5-methylbenzamide
CID 62515870
2-bromo-N-(5-chloro-2-methoxyphenyl)-4-fluorobenzamide
CID 9191956
N-(2-bromo-5-methylphenyl)-5-chloro-2-methoxybenzamide
CID 82707312
4-chloro-2-fluoro-N-[5-[(2-hydroxybenzoyl)amino]-2-methoxyphenyl]benzamide
CID 52701764
N-[3-[(4-chloro-2-fluorobenzoyl)amino]-4-methoxyphenyl]-3-fluoro-4-methylbenzamide
CID 52701788
N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide
CID 9210303
N-(2-fluoro-5-methylphenyl)-2,4,5-trimethoxybenzamide
CID 26881977

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide (CID 79770618) is N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide is COc1ccc(Cl)cc1NC(=O)c1ccc(C)cc1F.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide?
The InChIKey is ZPHLLNWCHHBKON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c1-9-3-5-11(12(17)7-9)15(19)18-13-8-10(16)4-6-14(13)20-2/h3-8H,1-2H3,(H,18,19).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide?
N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide has a molecular weight of 293.73 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide is sourced from PubChem (CID 79770618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).