2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide

C16H22FNO — CID 62512195

IUPAC2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide
SMILESCc1ccc(F)c(C(=O)NCC2CCCCC2C)c1
InChIInChI=1S/C16H22FNO/c1-11-7-8-15(17)14(9-11)16(19)18-10-13-6-4-3-5-12(13)2/h7-9,12-13H,3-6,10H2,1-2H3,(H,18,19)
InChIKeyBZGBRAIPQHGYMW-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.69
Rot. Bonds3

About 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide

2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide (PubChem CID 62512195) has the molecular formula C16H22FNO and a molecular weight of 263.36 g/mol. Its IUPAC name is 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide.

Molecular Properties

Compound Name2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide
PubChem CID62512195
Molecular FormulaC16H22FNO
Molecular Weight263.36 g/mol
Exact Mass263.17
IUPAC Name2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide
SMILESCc1ccc(F)c(C(=O)NCC2CCCCC2C)c1
InChIInChI=1S/C16H22FNO/c1-11-7-8-15(17)14(9-11)16(19)18-10-13-6-4-3-5-12(13)2/h7-9,12-13H,3-6,10H2,1-2H3,(H,18,19)
InChIKeyBZGBRAIPQHGYMW-UHFFFAOYSA-N
XLogP3.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-aminocyclohexyl)methyl]-2-fluoro-5-methylbenzamide
CID 64929794
N-[(2-chlorocyclohexyl)methyl]-2-fluoro-5-methylbenzamide
CID 113272633
2,3-difluoro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 62660422
2-fluoro-N-[(4-hydroxypyrrolidin-3-yl)methyl]-5-methylbenzamide
CID 120944490
5-(3-aminoprop-1-ynyl)-2-fluoro-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107420316
2-fluoro-5-methyl-N-[(6-methylpiperidin-2-yl)methyl]benzamide
CID 62516361
N-(2-cyclopentylethyl)-2-fluoro-5-methylbenzamide
CID 62509050
4,5-difluoro-2-[(2-methylcyclopentyl)methylcarbamoyl]benzoic acid
CID 107416687
2-amino-5-chloro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 55013606
2-fluoro-6-hydroxy-N-[(2-methylcyclohexyl)methyl]benzamide
CID 107015192
N-[(1,1-dioxothiolan-2-yl)methyl]-2-fluoro-5-methylbenzamide
CID 81038448
2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide
CID 55171474

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide?
The IUPAC name of 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide (CID 62512195) is 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide.
What is the SMILES notation for 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide?
The canonical SMILES for 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide is Cc1ccc(F)c(C(=O)NCC2CCCCC2C)c1.
What is the InChIKey of 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide?
The InChIKey is BZGBRAIPQHGYMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO/c1-11-7-8-15(17)14(9-11)16(19)18-10-13-6-4-3-5-12(13)2/h7-9,12-13H,3-6,10H2,1-2H3,(H,18,19).
What are the key properties of 2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide?
2-fluoro-5-methyl-N-[(2-methylcyclohexyl)methyl]benzamide has a molecular weight of 263.36 g/mol, XLogP of 3.69, 3 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-methylcyclohexyl)methyl]benzamide is sourced from PubChem (CID 62512195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).