N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide

C15H20FNO — CID 63212188

IUPACN-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide
SMILESCc1cc(C(=O)NCCC2CCCC2)ccc1F
InChIInChI=1S/C15H20FNO/c1-11-10-13(6-7-14(11)16)15(18)17-9-8-12-4-2-3-5-12/h6-7,10,12H,2-5,8-9H2,1H3,(H,17,18)
InChIKeyZVPZDOYJUPLJTH-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.44
Rot. Bonds4

About N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide

N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide (PubChem CID 63212188) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide
PubChem CID63212188
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC NameN-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide
SMILESCc1cc(C(=O)NCCC2CCCC2)ccc1F
InChIInChI=1S/C15H20FNO/c1-11-10-13(6-7-14(11)16)15(18)17-9-8-12-4-2-3-5-12/h6-7,10,12H,2-5,8-9H2,1H3,(H,17,18)
InChIKeyZVPZDOYJUPLJTH-UHFFFAOYSA-N
XLogP3.44
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(cyclopentylmethyl)-4-fluoro-3-methylbenzamide
CID 55163457
N-(2-cyclopentylethyl)-3-hydroxy-4-methylbenzamide
CID 54932367
3-bromo-N-(2-cyclohexylethyl)-4-fluorobenzamide
CID 107951613
4-amino-N-(2-cyclohexylethyl)-3-fluorobenzamide
CID 62680038
N-[2-(cyclopropylamino)ethyl]-4-fluoro-3-methylbenzamide;hydrochloride
CID 91659401
N-(2-cyclopentylethyl)-2-fluoro-5-methylbenzamide
CID 62509050
N-(3,3-dimethylbutyl)-4-fluoro-3-methylbenzamide
CID 115611491
2-cyclohexyl-1-(4-fluoro-3-methylphenyl)ethanone
CID 55096170
N-(2-cyclopentylethyl)-4-iodobenzamide
CID 60732288
3-fluoro-4-methyl-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119556963
4-fluoro-N-[(4-hydroxycyclohexyl)methyl]-3-methylbenzamide
CID 114146256
N-[2-(carbamoylamino)ethyl]-4-fluoro-3-methylbenzamide
CID 78995301

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide?
The IUPAC name of N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide (CID 63212188) is N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide.
What is the SMILES notation for N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide?
The canonical SMILES for N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide is Cc1cc(C(=O)NCCC2CCCC2)ccc1F.
What is the InChIKey of N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide?
The InChIKey is ZVPZDOYJUPLJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c1-11-10-13(6-7-14(11)16)15(18)17-9-8-12-4-2-3-5-12/h6-7,10,12H,2-5,8-9H2,1H3,(H,17,18).
What are the key properties of N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide?
N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide has a molecular weight of 249.33 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide is sourced from PubChem (CID 63212188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).