2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide

C15H21FN2O — CID 62515661

IUPAC2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide
SMILESCNC1CCC(NC(=O)c2cc(C)ccc2F)CC1
InChIInChI=1S/C15H21FN2O/c1-10-3-8-14(16)13(9-10)15(19)18-12-6-4-11(17-2)5-7-12/h3,8-9,11-12,17H,4-7H2,1-2H3,(H,18,19)
InChIKeyWUAWZDPOAOAYIA-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.39
Rot. Bonds3

About 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide

2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide (PubChem CID 62515661) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide.

Molecular Properties

Compound Name2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide
PubChem CID62515661
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide
SMILESCNC1CCC(NC(=O)c2cc(C)ccc2F)CC1
InChIInChI=1S/C15H21FN2O/c1-10-3-8-14(16)13(9-10)15(19)18-12-6-4-11(17-2)5-7-12/h3,8-9,11-12,17H,4-7H2,1-2H3,(H,18,19)
InChIKeyWUAWZDPOAOAYIA-UHFFFAOYSA-N
XLogP2.39
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-(4-hydroxycyclohexyl)-5-methylbenzamide
CID 62508927
N-(4-chlorocyclohexyl)-2-fluoro-5-methylbenzamide
CID 113271582
N-(4-aminocyclohexyl)-2-fluoro-5-methylbenzamide;hydrochloride
CID 119476329
2-fluoro-5-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119387686
N-(1,1-dioxothian-4-yl)-2-fluoro-5-methylbenzamide
CID 62509384
2-fluoro-5-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119451435
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-fluoro-5-methylbenzamide;hydrochloride
CID 119456958
2-fluoro-5-methyl-N-(3,3,5,5-tetramethylcyclohexyl)benzamide
CID 103966079
2,3,4-trifluoro-N-[4-(methylamino)cyclohexyl]benzamide
CID 79749208
2-fluoro-4-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119389290
2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide
CID 55171474
2-fluoro-5-methyl-N-(2-methyloxolan-3-yl)benzamide
CID 82726276

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide?
The IUPAC name of 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide (CID 62515661) is 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide.
What is the SMILES notation for 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide?
The canonical SMILES for 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide is CNC1CCC(NC(=O)c2cc(C)ccc2F)CC1.
What is the InChIKey of 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide?
The InChIKey is WUAWZDPOAOAYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-10-3-8-14(16)13(9-10)15(19)18-12-6-4-11(17-2)5-7-12/h3,8-9,11-12,17H,4-7H2,1-2H3,(H,18,19).
What are the key properties of 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide?
2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide has a molecular weight of 264.34 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methyl-N-[4-(methylamino)cyclohexyl]benzamide is sourced from PubChem (CID 62515661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).