2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide

C16H25N3O2 — CID 79322694

IUPAC2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CN2CCC(N)CC2)c1
InChIInChI=1S/C16H25N3O2/c1-2-10-21-15-5-3-4-14(11-15)18-16(20)12-19-8-6-13(17)7-9-19/h3-5,11,13H,2,6-10,12,17H2,1H3,(H,18,20)
InChIKeyYSVOVOSPNYJKBJ-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.84
Rot. Bonds6

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

2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide (PubChem CID 79322694) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide
PubChem CID79322694
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CN2CCC(N)CC2)c1
InChIInChI=1S/C16H25N3O2/c1-2-10-21-15-5-3-4-14(11-15)18-16(20)12-19-8-6-13(17)7-9-19/h3-5,11,13H,2,6-10,12,17H2,1H3,(H,18,20)
InChIKeyYSVOVOSPNYJKBJ-UHFFFAOYSA-N
XLogP1.84
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-piperazin-1-yl-N-(3-propoxyphenyl)acetamide
CID 60851959
2-(azepan-1-yl)-N-[3-(2-methoxyethoxy)phenyl]acetamide
CID 54814501
2-(1,4-diazepan-1-yl)-N-(3-ethoxyphenyl)acetamide
CID 62838844
2-(ethylamino)-N-(3-propoxyphenyl)acetamide
CID 54820704
2-(3-aminopyrrolidin-1-yl)-N-(3-ethylphenyl)acetamide
CID 62067698
ethyl 1-[2-oxo-2-(3-phenylmethoxyanilino)ethyl]piperidine-4-carboxylate
CID 54837787
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-piperazin-1-ylacetamide
CID 60851602
2-amino-N-(3-propoxyphenyl)cyclohexane-1-carboxamide
CID 64822364
2-(4-aminopiperidin-1-yl)-N-(4-ethoxy-3-fluorophenyl)acetamide
CID 115738459
2-(dimethylamino)-N-(3-propoxyphenyl)acetamide
CID 54843924
N-[3-(2-phenylethoxy)phenyl]-2-piperidin-1-ylacetamide
CID 54813456
ethyl N-(3-propoxyphenyl)carbamate
CID 60643143

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide (CID 79322694) is 2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide is CCCOc1cccc(NC(=O)CN2CCC(N)CC2)c1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide?
The InChIKey is YSVOVOSPNYJKBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-2-10-21-15-5-3-4-14(11-15)18-16(20)12-19-8-6-13(17)7-9-19/h3-5,11,13H,2,6-10,12,17H2,1H3,(H,18,20).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(3-propoxyphenyl)acetamide has a molecular weight of 291.40 g/mol, XLogP of 1.84, 6 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-(3-propoxyphenyl)acetamide is sourced from PubChem (CID 79322694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).