2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide

C15H13ClFNO2 — CID 2591172

IUPAC2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide
SMILESCCOc1ccccc1NC(=O)c1ccc(F)cc1Cl
InChIInChI=1S/C15H13ClFNO2/c1-2-20-14-6-4-3-5-13(14)18-15(19)11-8-7-10(17)9-12(11)16/h3-9H,2H2,1H3,(H,18,19)
InChIKeySCARPMPPVLDCHC-UHFFFAOYSA-N
MW293.73 g/mol
LogP4.13
Rot. Bonds4

About 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide

2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide (PubChem CID 2591172) has the molecular formula C15H13ClFNO2 and a molecular weight of 293.73 g/mol. Its IUPAC name is 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide.

Molecular Properties

Compound Name2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide
PubChem CID2591172
Molecular FormulaC15H13ClFNO2
Molecular Weight293.73 g/mol
Exact Mass293.06
IUPAC Name2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide
SMILESCCOc1ccccc1NC(=O)c1ccc(F)cc1Cl
InChIInChI=1S/C15H13ClFNO2/c1-2-20-14-6-4-3-5-13(14)18-15(19)11-8-7-10(17)9-12(11)16/h3-9H,2H2,1H3,(H,18,19)
InChIKeySCARPMPPVLDCHC-UHFFFAOYSA-N
XLogP4.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.73
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-benzamido-2,5-diethoxyphenyl)-2-chloro-4-fluorobenzamide
CID 2103386
2-chloro-N-(3,4-diethoxyphenyl)-4-fluorobenzamide
CID 26212713
methyl 2-[(2-chloro-4-fluorobenzoyl)amino]benzoate
CID 17418027
2,4-diethoxy-N-(2-ethoxyphenyl)benzamide
CID 17340647
5-amino-2,3-dichloro-N-(2-ethoxyphenyl)benzamide
CID 107183316
2,4-dichloro-N-[(2-ethoxyphenyl)carbamothioyl]benzamide
CID 1226903
2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide
CID 26087324
2,4-dichloro-N-(5-chloro-2-ethoxyphenyl)benzamide
CID 4779142
N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206274
N-(2-ethoxyphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380223
5-bromo-2-chloro-N-(2-ethoxy-4-fluorophenyl)benzamide
CID 60794303
3,5-dichloro-N-(2-ethoxyphenyl)benzamide
CID 2442507

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide?
The IUPAC name of 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide (CID 2591172) is 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide.
What is the SMILES notation for 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide?
The canonical SMILES for 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide is CCOc1ccccc1NC(=O)c1ccc(F)cc1Cl.
What is the InChIKey of 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide?
The InChIKey is SCARPMPPVLDCHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c1-2-20-14-6-4-3-5-13(14)18-15(19)11-8-7-10(17)9-12(11)16/h3-9H,2H2,1H3,(H,18,19).
What are the key properties of 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide?
2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide has a molecular weight of 293.73 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide is sourced from PubChem (CID 2591172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).