2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide

C17H11ClFNO — CID 26087324

IUPAC2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide
SMILESO=C(Nc1cccc2ccccc12)c1ccc(F)cc1Cl
InChIInChI=1S/C17H11ClFNO/c18-15-10-12(19)8-9-14(15)17(21)20-16-7-3-5-11-4-1-2-6-13(11)16/h1-10H,(H,20,21)
InChIKeyVLHNHCDCCQZTTR-UHFFFAOYSA-N
MW299.73 g/mol
LogP4.88
Rot. Bonds2

About 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide

2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide (PubChem CID 26087324) has the molecular formula C17H11ClFNO and a molecular weight of 299.73 g/mol. Its IUPAC name is 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide.

Molecular Properties

Compound Name2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide
PubChem CID26087324
Molecular FormulaC17H11ClFNO
Molecular Weight299.73 g/mol
Exact Mass299.05
IUPAC Name2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide
SMILESO=C(Nc1cccc2ccccc12)c1ccc(F)cc1Cl
InChIInChI=1S/C17H11ClFNO/c18-15-10-12(19)8-9-14(15)17(21)20-16-7-3-5-11-4-1-2-6-13(11)16/h1-10H,(H,20,21)
InChIKeyVLHNHCDCCQZTTR-UHFFFAOYSA-N
XLogP4.88
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.73
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-difluoro-N-naphthalen-1-ylbenzamide
CID 2981920
2,5-dichloro-N-naphthalen-1-ylbenzamide
CID 2166526
N-(3-benzamido-2-methylphenyl)-2-chloro-4-fluorobenzamide
CID 55900045
2-chloro-N-(2-ethoxyphenyl)-4-fluorobenzamide
CID 2591172
methyl 2-[(2-chloro-4-fluorobenzoyl)amino]benzoate
CID 17418027
2-chloro-N-(2,5-difluorophenyl)-4-fluorobenzamide
CID 26361023
2,4-dichloro-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzamide
CID 24637845
2-chloro-4-fluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 6468797
(2R)-2-(2-chloro-4-fluorophenoxy)-N-naphthalen-1-ylpropanamide
CID 2537239
2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide
CID 80710420
2-amino-5-chloro-N-naphthalen-1-ylpyridine-4-carboxamide
CID 114921449
5-fluoro-N-naphthalen-1-yl-1H-indole-2-carboxamide
CID 118425440

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide?
The IUPAC name of 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide (CID 26087324) is 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide.
What is the SMILES notation for 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide?
The canonical SMILES for 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide is O=C(Nc1cccc2ccccc12)c1ccc(F)cc1Cl.
What is the InChIKey of 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide?
The InChIKey is VLHNHCDCCQZTTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClFNO/c18-15-10-12(19)8-9-14(15)17(21)20-16-7-3-5-11-4-1-2-6-13(11)16/h1-10H,(H,20,21).
What are the key properties of 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide?
2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide has a molecular weight of 299.73 g/mol, XLogP of 4.88, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide is sourced from PubChem (CID 26087324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).