2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide

C13H17F2N3O — CID 43556684

IUPAC2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide
SMILESNC1CCN(CC(=O)Nc2cc(F)cc(F)c2)CC1
InChIInChI=1S/C13H17F2N3O/c14-9-5-10(15)7-12(6-9)17-13(19)8-18-3-1-11(16)2-4-18/h5-7,11H,1-4,8,16H2,(H,17,19)
InChIKeyYSTKFAZUZLFYSN-UHFFFAOYSA-N
MW269.29 g/mol
LogP1.33
Rot. Bonds3

About 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide

2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide (PubChem CID 43556684) has the molecular formula C13H17F2N3O and a molecular weight of 269.29 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide
PubChem CID43556684
Molecular FormulaC13H17F2N3O
Molecular Weight269.29 g/mol
Exact Mass269.13
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide
SMILESNC1CCN(CC(=O)Nc2cc(F)cc(F)c2)CC1
InChIInChI=1S/C13H17F2N3O/c14-9-5-10(15)7-12(6-9)17-13(19)8-18-3-1-11(16)2-4-18/h5-7,11H,1-4,8,16H2,(H,17,19)
InChIKeyYSTKFAZUZLFYSN-UHFFFAOYSA-N
XLogP1.33
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.29
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminopyrrolidin-1-yl)-N-(3,5-difluorophenyl)acetamide;hydrochloride
CID 119917422
2-(4-aminopiperidin-1-yl)-N-(3,5-dichloro-4-hydroxyphenyl)acetamide
CID 107680442
2-(4-aminopiperidin-1-yl)-N-(3-fluoro-4-hydroxyphenyl)acetamide
CID 79327970
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-(3,5-difluorophenyl)acetamide
CID 115969204
2-(4-aminopiperidin-1-yl)-N-[4-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119907372
2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide
CID 115738459
N-(4-fluorophenyl)-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60967333
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(3-fluoro-4-methylphenyl)acetamide;hydrochloride
CID 119933635
2-(3-aminopyrrolidin-1-yl)-N-(3-chloro-4-fluorophenyl)acetamide;hydrochloride
CID 119917629
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(3,5-difluorophenyl)acetamide;hydrochloride
CID 119926972
5-[[2-(4-aminopiperidin-1-yl)acetyl]amino]-2-methylbenzoic acid
CID 79323581
2-(4-aminopiperidin-1-yl)-N-(1-methyl-2-oxo-4-pyridinyl)acetamide
CID 118227484

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide (CID 43556684) is 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide is NC1CCN(CC(=O)Nc2cc(F)cc(F)c2)CC1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide?
The InChIKey is YSTKFAZUZLFYSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F2N3O/c14-9-5-10(15)7-12(6-9)17-13(19)8-18-3-1-11(16)2-4-18/h5-7,11H,1-4,8,16H2,(H,17,19).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide has a molecular weight of 269.29 g/mol, XLogP of 1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide is sourced from PubChem (CID 43556684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).