N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide

C11H21N3O3 — CID 55033154

IUPACN-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide
SMILESCOCCCNC(=O)CNC1CCCNC1=O
InChIInChI=1S/C11H21N3O3/c1-17-7-3-6-12-10(15)8-14-9-4-2-5-13-11(9)16/h9,14H,2-8H2,1H3,(H,12,15)(H,13,16)
InChIKeyAVNJEXDAMYXXDJ-UHFFFAOYSA-N
MW243.31 g/mol
LogP-0.99
Rot. Bonds7

About N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide

N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide (PubChem CID 55033154) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide
PubChem CID55033154
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC NameN-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide
SMILESCOCCCNC(=O)CNC1CCCNC1=O
InChIInChI=1S/C11H21N3O3/c1-17-7-3-6-12-10(15)8-14-9-4-2-5-13-11(9)16/h9,14H,2-8H2,1H3,(H,12,15)(H,13,16)
InChIKeyAVNJEXDAMYXXDJ-UHFFFAOYSA-N
XLogP-0.99
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-0.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide?
The IUPAC name of N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide (CID 55033154) is N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide?
The canonical SMILES for N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide is COCCCNC(=O)CNC1CCCNC1=O.
What is the InChIKey of N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide?
The InChIKey is AVNJEXDAMYXXDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-17-7-3-6-12-10(15)8-14-9-4-2-5-13-11(9)16/h9,14H,2-8H2,1H3,(H,12,15)(H,13,16).
What are the key properties of N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide?
N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide has a molecular weight of 243.31 g/mol, XLogP of -0.99, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-[(2-oxopiperidin-3-yl)amino]acetamide is sourced from PubChem (CID 55033154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).