2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide

C14H20FN3O — CID 54989142

IUPAC2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide
SMILESNCc1cc(F)ccc1N(CC(N)=O)C1CCCC1
InChIInChI=1S/C14H20FN3O/c15-11-5-6-13(10(7-11)8-16)18(9-14(17)19)12-3-1-2-4-12/h5-7,12H,1-4,8-9,16H2,(H2,17,19)
InChIKeyAMDLRMBYJPYPRD-UHFFFAOYSA-N
MW265.33 g/mol
LogP1.52
Rot. Bonds5

About 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide

2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide (PubChem CID 54989142) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide
PubChem CID54989142
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC Name2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide
SMILESNCc1cc(F)ccc1N(CC(N)=O)C1CCCC1
InChIInChI=1S/C14H20FN3O/c15-11-5-6-13(10(7-11)8-16)18(9-14(17)19)12-3-1-2-4-12/h5-7,12H,1-4,8-9,16H2,(H2,17,19)
InChIKeyAMDLRMBYJPYPRD-UHFFFAOYSA-N
XLogP1.52
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-cyclohexyl-N-ethyl-4-fluoroaniline
CID 43313792
2-(4-carbamothioyl-N-cyclopentyl-2,3-difluoroanilino)acetamide
CID 107934762
2-[N-cyclopentyl-4-fluoro-2-(hydroxymethyl)anilino]ethanol
CID 54994152
2-[[2-(aminomethyl)-4-fluorophenyl]methyl-(2-amino-2-oxoethyl)amino]acetamide
CID 63289211
2-[(tert-butylamino)methyl]-N-cyclopentyl-N-ethyl-4-fluoroaniline
CID 63550590
2-[2-bromo-N-cyclopentyl-4-(1-hydroxyethyl)anilino]acetamide
CID 62908195
2-(3-amino-N-cyclopentyl-4-methylanilino)acetamide
CID 55130364
2-[N-cyclopentyl-4-(ethylaminomethyl)-2-methylanilino]acetamide
CID 62122770
2-(bromomethyl)-N-cyclopentyl-4-fluoro-N-(3-methylbutyl)aniline
CID 107084629
2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide
CID 80629884
2-[cyclopentyl-[(2,5-difluorophenyl)methyl]amino]-N'-hydroxyethanimidamide
CID 78995782
2-[(3-bromo-4-pyridinyl)-cyclopentylamino]acetamide
CID 104778295

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide?
The IUPAC name of 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide (CID 54989142) is 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide.
What is the SMILES notation for 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide?
The canonical SMILES for 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide is NCc1cc(F)ccc1N(CC(N)=O)C1CCCC1.
What is the InChIKey of 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide?
The InChIKey is AMDLRMBYJPYPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c15-11-5-6-13(10(7-11)8-16)18(9-14(17)19)12-3-1-2-4-12/h5-7,12H,1-4,8-9,16H2,(H2,17,19).
What are the key properties of 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide?
2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide has a molecular weight of 265.33 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)-N-cyclopentyl-4-fluoroanilino]acetamide is sourced from PubChem (CID 54989142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).