4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide

C16H14ClFN2O2 — CID 17469995

IUPAC4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide
SMILESCCNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C16H14ClFN2O2/c1-2-19-16(22)13-8-5-11(17)9-14(13)20-15(21)10-3-6-12(18)7-4-10/h3-9H,2H2,1H3,(H,19,22)(H,20,21)
InChIKeyYCYDMVYKYYHIJN-UHFFFAOYSA-N
MW320.75 g/mol
LogP3.48
Rot. Bonds4

About 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide

4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide (PubChem CID 17469995) has the molecular formula C16H14ClFN2O2 and a molecular weight of 320.75 g/mol. Its IUPAC name is 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide.

Molecular Properties

Compound Name4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide
PubChem CID17469995
Molecular FormulaC16H14ClFN2O2
Molecular Weight320.75 g/mol
Exact Mass320.07
IUPAC Name4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide
SMILESCCNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C16H14ClFN2O2/c1-2-19-16(22)13-8-5-11(17)9-14(13)20-15(21)10-3-6-12(18)7-4-10/h3-9H,2H2,1H3,(H,19,22)(H,20,21)
InChIKeyYCYDMVYKYYHIJN-UHFFFAOYSA-N
XLogP3.48
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.75
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(4'-chloro-(1,1'-biphenyl)-2-yl)-2-hydroxypyridine-3-carboxamide
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N-(4-Amino-2-chloro-5-methylphenyl)benzamide
CID 67133
Clanfenur
CID 68684
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CID 200017
2-amino-N-(3-chlorophenyl)benzamide
CID 720859
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CID 532008
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CID 346674

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide?
The IUPAC name of 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide (CID 17469995) is 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide.
What is the SMILES notation for 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide?
The canonical SMILES for 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide is CCNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(F)cc1.
What is the InChIKey of 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide?
The InChIKey is YCYDMVYKYYHIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClFN2O2/c1-2-19-16(22)13-8-5-11(17)9-14(13)20-15(21)10-3-6-12(18)7-4-10/h3-9H,2H2,1H3,(H,19,22)(H,20,21).
What are the key properties of 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide?
4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide has a molecular weight of 320.75 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-ethyl-2-[(4-fluorobenzoyl)amino]benzamide is sourced from PubChem (CID 17469995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).