N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide

C15H20F2N2O — CID 114546012

IUPACN-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide
SMILESCC1(C)CCC(NCC(=O)Nc2c(F)cccc2F)C1
InChIInChI=1S/C15H20F2N2O/c1-15(2)7-6-10(8-15)18-9-13(20)19-14-11(16)4-3-5-12(14)17/h3-5,10,18H,6-9H2,1-2H3,(H,19,20)
InChIKeyGEETYMYKGFEBFO-UHFFFAOYSA-N
MW282.33 g/mol
LogP3.07
Rot. Bonds4

About N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide

N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide (PubChem CID 114546012) has the molecular formula C15H20F2N2O and a molecular weight of 282.33 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide
PubChem CID114546012
Molecular FormulaC15H20F2N2O
Molecular Weight282.33 g/mol
Exact Mass282.15
IUPAC NameN-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide
SMILESCC1(C)CCC(NCC(=O)Nc2c(F)cccc2F)C1
InChIInChI=1S/C15H20F2N2O/c1-15(2)7-6-10(8-15)18-9-13(20)19-14-11(16)4-3-5-12(14)17/h3-5,10,18H,6-9H2,1-2H3,(H,19,20)
InChIKeyGEETYMYKGFEBFO-UHFFFAOYSA-N
XLogP3.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.33
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Prilocaine
CID 4906
2-(benzylamino)-N-(4-fluorophenyl)acetamide
CID 670654
2-Cyclohexylamino-N-(3-trifluoromethyl-phenyl)-acetamide
CID 856302
N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methylcyclopentanecarboxamide
CID 2524258
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(3-fluoro-4-methylphenyl)acetamide
CID 2539057
o-Desmethyl prilocaine
CID 43083688
2-[cyclohexyl(methyl)amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 2465671
(S)-N-(2-Methylphenyl)-2-(propylamino)propanamide
CID 6603976
2-(ethylamino)-N-(2-(trifluoromethyl)phenyl)acetamide
CID 2410077
N-(3-fluorophenyl)-2-(methylamino)acetamide
CID 2414098
2-[[2-(4-fluoroanilino)-2-oxoethyl]-methylamino]-N-(4-methylcyclohexyl)acetamide
CID 16331063
2-cyclopentyl-N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethylacetamide
CID 24980704

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide (CID 114546012) is N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide is CC1(C)CCC(NCC(=O)Nc2c(F)cccc2F)C1.
What is the InChIKey of N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide?
The InChIKey is GEETYMYKGFEBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O/c1-15(2)7-6-10(8-15)18-9-13(20)19-14-11(16)4-3-5-12(14)17/h3-5,10,18H,6-9H2,1-2H3,(H,19,20).
What are the key properties of N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide?
N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide has a molecular weight of 282.33 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide is sourced from PubChem (CID 114546012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).