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

C15H23N3O3 — CID 79322239

IUPAC2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCC(N)CC2)cc1OC
InChIInChI=1S/C15H23N3O3/c1-20-13-4-3-12(9-14(13)21-2)17-15(19)10-18-7-5-11(16)6-8-18/h3-4,9,11H,5-8,10,16H2,1-2H3,(H,17,19)
InChIKeyPFEXCDSFZLRPIZ-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.07
Rot. Bonds5

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

2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide (PubChem CID 79322239) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
PubChem CID79322239
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCC(N)CC2)cc1OC
InChIInChI=1S/C15H23N3O3/c1-20-13-4-3-12(9-14(13)21-2)17-15(19)10-18-7-5-11(16)6-8-18/h3-4,9,11H,5-8,10,16H2,1-2H3,(H,17,19)
InChIKeyPFEXCDSFZLRPIZ-UHFFFAOYSA-N
XLogP1.07
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-methylpiperidine-4-carboxamide
CID 16909656
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide;hydrochloride
CID 120776425
1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-propylpiperidine-4-carboxamide
CID 16909550
N-(3,4-dimethoxyphenyl)-2-(4-pyrazol-1-ylpiperidin-1-yl)acetamide
CID 136524524
N-(3,4-dimethoxyphenyl)-2-[4-[(3,5-dimethylpyrazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 90495459
2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide
CID 115738459
N-(3,4-dimethoxyphenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 119920227
1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-(2,5-dimethoxyphenyl)piperidine-4-carboxamide
CID 16909624
1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 16909601
N-(3-chloro-4-methylphenyl)-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 16909629
N-(3,4-dimethoxyphenyl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930671
2-(4-aminopiperidin-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide;hydrochloride
CID 119908061

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide (CID 79322239) is 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide is COc1ccc(NC(=O)CN2CCC(N)CC2)cc1OC.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide?
The InChIKey is PFEXCDSFZLRPIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-20-13-4-3-12(9-14(13)21-2)17-15(19)10-18-7-5-11(16)6-8-18/h3-4,9,11H,5-8,10,16H2,1-2H3,(H,17,19).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide has a molecular weight of 293.37 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide is sourced from PubChem (CID 79322239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).