2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide

C14H18FNO — CID 55171474

IUPAC2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide
SMILESCc1ccc(F)c(C(=O)NC2CCCC2C)c1
InChIInChI=1S/C14H18FNO/c1-9-6-7-12(15)11(8-9)14(17)16-13-5-3-4-10(13)2/h6-8,10,13H,3-5H2,1-2H3,(H,16,17)
InChIKeyXHBIMTYGJKZSFR-UHFFFAOYSA-N
MW235.30 g/mol
LogP3.05
Rot. Bonds2

About 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide

2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide (PubChem CID 55171474) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide.

Molecular Properties

Compound Name2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide
PubChem CID55171474
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide
SMILESCc1ccc(F)c(C(=O)NC2CCCC2C)c1
InChIInChI=1S/C14H18FNO/c1-9-6-7-12(15)11(8-9)14(17)16-13-5-3-4-10(13)2/h6-8,10,13H,3-5H2,1-2H3,(H,16,17)
InChIKeyXHBIMTYGJKZSFR-UHFFFAOYSA-N
XLogP3.05
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide?
The IUPAC name of 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide (CID 55171474) is 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide.
What is the SMILES notation for 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide?
The canonical SMILES for 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide is Cc1ccc(F)c(C(=O)NC2CCCC2C)c1.
What is the InChIKey of 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide?
The InChIKey is XHBIMTYGJKZSFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-9-6-7-12(15)11(8-9)14(17)16-13-5-3-4-10(13)2/h6-8,10,13H,3-5H2,1-2H3,(H,16,17).
What are the key properties of 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide?
2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide has a molecular weight of 235.30 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide is sourced from PubChem (CID 55171474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).