2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide

C15H22FN3O2 — CID 115738459

IUPAC2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide
SMILESCCOc1ccc(NC(=O)CN2CCC(N)CC2)cc1F
InChIInChI=1S/C15H22FN3O2/c1-2-21-14-4-3-12(9-13(14)16)18-15(20)10-19-7-5-11(17)6-8-19/h3-4,9,11H,2,5-8,10,17H2,1H3,(H,18,20)
InChIKeyJVZWFNLHZBQSCG-UHFFFAOYSA-N
MW295.36 g/mol
LogP1.59
Rot. Bonds5

About 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide

2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide (PubChem CID 115738459) has the molecular formula C15H22FN3O2 and a molecular weight of 295.36 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide
PubChem CID115738459
Molecular FormulaC15H22FN3O2
Molecular Weight295.36 g/mol
Exact Mass295.17
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide
SMILESCCOc1ccc(NC(=O)CN2CCC(N)CC2)cc1F
InChIInChI=1S/C15H22FN3O2/c1-2-21-14-4-3-12(9-13(14)16)18-15(20)10-19-7-5-11(17)6-8-19/h3-4,9,11H,2,5-8,10,17H2,1H3,(H,18,20)
InChIKeyJVZWFNLHZBQSCG-UHFFFAOYSA-N
XLogP1.59
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-(3-fluoro-4-hydroxyphenyl)acetamide
CID 79327970
2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
CID 79322239
2-(4-aminopiperidin-1-yl)-N-(2-ethoxy-4-fluorophenyl)acetamide
CID 79322871
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(3-fluoro-4-methylphenyl)acetamide;hydrochloride
CID 119933635
3-amino-N-(4-ethoxy-3-fluorophenyl)propanamide
CID 96672740
2-(4-aminopiperidin-1-yl)-N-(3,5-difluorophenyl)acetamide
CID 43556684
N-(3,4-difluorophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-yl]acetamide
CID 29325843
N-(4-ethoxy-3-fluorophenyl)-3,3-dimethylbutanamide
CID 110777393
2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide
CID 79322694
5-[[2-(4-aminopiperidin-1-yl)acetyl]amino]-2-methylbenzoic acid
CID 79323581
2-(4-aminophenyl)-N-(4-ethoxy-3-fluorophenyl)acetamide
CID 115738458
2-(3-aminopyrrolidin-1-yl)-N-(3-chloro-4-fluorophenyl)acetamide;hydrochloride
CID 119917629

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide (CID 115738459) is 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide is CCOc1ccc(NC(=O)CN2CCC(N)CC2)cc1F.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide?
The InChIKey is JVZWFNLHZBQSCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O2/c1-2-21-14-4-3-12(9-13(14)16)18-15(20)10-19-7-5-11(17)6-8-19/h3-4,9,11H,2,5-8,10,17H2,1H3,(H,18,20).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide has a molecular weight of 295.36 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide is sourced from PubChem (CID 115738459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).