2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide

C18H14FNO — CID 80710420

IUPAC2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide
SMILESCc1cccc(C(=O)Nc2cccc3ccccc23)c1F
InChIInChI=1S/C18H14FNO/c1-12-6-4-10-15(17(12)19)18(21)20-16-11-5-8-13-7-2-3-9-14(13)16/h2-11H,1H3,(H,20,21)
InChIKeyODDAESQDTFNVTR-UHFFFAOYSA-N
MW279.31 g/mol
LogP4.54
Rot. Bonds2

About 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide

2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide (PubChem CID 80710420) has the molecular formula C18H14FNO and a molecular weight of 279.31 g/mol. Its IUPAC name is 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide.

Molecular Properties

Compound Name2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide
PubChem CID80710420
Molecular FormulaC18H14FNO
Molecular Weight279.31 g/mol
Exact Mass279.11
IUPAC Name2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide
SMILESCc1cccc(C(=O)Nc2cccc3ccccc23)c1F
InChIInChI=1S/C18H14FNO/c1-12-6-4-10-15(17(12)19)18(21)20-16-11-5-8-13-7-2-3-9-14(13)16/h2-11H,1H3,(H,20,21)
InChIKeyODDAESQDTFNVTR-UHFFFAOYSA-N
XLogP4.54
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(naphthalen-1-ylcarbamoyl)benzoic acid
CID 67617466
N-(2-butan-2-ylphenyl)-2-fluoro-3-methylbenzamide
CID 80710438
N-[2-(difluoromethylsulfanyl)phenyl]-2-fluoro-3-methylbenzamide
CID 80710567
2,4-difluoro-N-naphthalen-1-ylbenzamide
CID 2981920
N-isoquinolin-5-yl-2-methylbenzamide
CID 110483002
2-bromo-N-(2-fluoro-3-methylphenyl)benzamide
CID 113351864
N-[4-[(2-methylphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide
CID 2988389
N-(2-chloro-3-pyridinyl)-2-fluoro-3-methylbenzamide
CID 80718513
2-chloro-4-fluoro-N-naphthalen-1-ylbenzamide
CID 26087324
N-(2,5-dimethylphenyl)naphthalene-1-carboxamide
CID 1278696
N-(5-amino-2,4-dimethylphenyl)-2-fluoro-3-methylbenzamide
CID 104756953
N-(4-chloro-3-pyridinyl)-2-fluoro-3-methylbenzamide
CID 80712464

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide?
The IUPAC name of 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide (CID 80710420) is 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide.
What is the SMILES notation for 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide?
The canonical SMILES for 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide is Cc1cccc(C(=O)Nc2cccc3ccccc23)c1F.
What is the InChIKey of 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide?
The InChIKey is ODDAESQDTFNVTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FNO/c1-12-6-4-10-15(17(12)19)18(21)20-16-11-5-8-13-7-2-3-9-14(13)16/h2-11H,1H3,(H,20,21).
What are the key properties of 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide?
2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide has a molecular weight of 279.31 g/mol, XLogP of 4.54, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-methyl-N-naphthalen-1-ylbenzamide is sourced from PubChem (CID 80710420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).