2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide

C11H23N3O2 — CID 61295530

IUPAC2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide
SMILESCOCCCNC(=O)CN1CCCC(N)C1
InChIInChI=1S/C11H23N3O2/c1-16-7-3-5-13-11(15)9-14-6-2-4-10(12)8-14/h10H,2-9,12H2,1H3,(H,13,15)
InChIKeyMVHZPDHRMLCIEN-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.44
Rot. Bonds6

About 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide

2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide (PubChem CID 61295530) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide.

Molecular Properties

Compound Name2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide
PubChem CID61295530
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide
SMILESCOCCCNC(=O)CN1CCCC(N)C1
InChIInChI=1S/C11H23N3O2/c1-16-7-3-5-13-11(15)9-14-6-2-4-10(12)8-14/h10H,2-9,12H2,1H3,(H,13,15)
InChIKeyMVHZPDHRMLCIEN-UHFFFAOYSA-N
XLogP-0.44
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[(3R)-3-aminopyrrolidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 115301859
2-[(3S)-3-(aminomethyl)piperidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 94209171
N-(3-methoxypropyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 78787278
2-[3-[(2-methoxyethylamino)methyl]piperidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 63849542
2-[3-[(tert-butylamino)methyl]piperidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 63848836
2-[(3S)-3-(aminomethyl)piperidin-1-yl]-N-(2-methoxyethyl)acetamide
CID 129367244
2-(4-aminopiperidin-1-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide
CID 79327489
2-(3-aminopyrrolidin-1-yl)-N-(3-propan-2-yloxypropyl)acetamide
CID 55030129
methyl 1-[2-(3-methoxypropylamino)-2-oxoethyl]pyrrolidine-3-carboxylate
CID 112730658
2-(3-aminopyrrolidin-1-yl)-N-butylacetamide
CID 62067276
2-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 79410145
2-(3-aminopiperidin-1-yl)-N-(2-phenoxyethyl)acetamide;hydrochloride
CID 119910163

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide?
The IUPAC name of 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide (CID 61295530) is 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide.
What is the SMILES notation for 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide?
The canonical SMILES for 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide is COCCCNC(=O)CN1CCCC(N)C1.
What is the InChIKey of 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide?
The InChIKey is MVHZPDHRMLCIEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-16-7-3-5-13-11(15)9-14-6-2-4-10(12)8-14/h10H,2-9,12H2,1H3,(H,13,15).
What are the key properties of 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide?
2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide has a molecular weight of 229.32 g/mol, XLogP of -0.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopiperidin-1-yl)-N-(3-methoxypropyl)acetamide is sourced from PubChem (CID 61295530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).