N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide

C13H25N3O2 — CID 112685302

IUPACN-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide
SMILESCCCCNC(=O)CNCC(=O)N1CCCCC1
InChIInChI=1S/C13H25N3O2/c1-2-3-7-15-12(17)10-14-11-13(18)16-8-5-4-6-9-16/h14H,2-11H2,1H3,(H,15,17)
InChIKeyIEISLIQNHLXECK-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.50
Rot. Bonds7

About N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide

N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide (PubChem CID 112685302) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide.

Molecular Properties

Compound NameN-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide
PubChem CID112685302
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide
SMILESCCCCNC(=O)CNCC(=O)N1CCCCC1
InChIInChI=1S/C13H25N3O2/c1-2-3-7-15-12(17)10-14-11-13(18)16-8-5-4-6-9-16/h14H,2-11H2,1H3,(H,15,17)
InChIKeyIEISLIQNHLXECK-UHFFFAOYSA-N
XLogP0.50
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide
CID 115586639
N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
CID 113406059
N-[2-(azepan-1-yl)-2-oxoethyl]pentanamide
CID 112995931
1-(azepan-1-yl)-3-(butylamino)propan-1-one
CID 109012440
2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide
CID 43402015
N-butyl-2-pyrrolidin-1-ylacetamide
CID 110687965
2-methyl-1-(2-oxo-2-piperidin-1-ylethyl)-3-pentylguanidine
CID 111129757
N-(cyclopropylmethyl)-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide
CID 112685310
2-(2-aminoethylamino)-1-(azepan-1-yl)ethanone
CID 62140336
2-(2-aminoethylamino)-1-piperidin-1-ylethanone
CID 62140335
N-[2-oxo-2-(propylamino)ethyl]piperidine-1-carboxamide
CID 115578708
2-(azepan-1-yl)-N-pentylacetamide
CID 109006030

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide?
The IUPAC name of N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide (CID 112685302) is N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide.
What is the SMILES notation for N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide?
The canonical SMILES for N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide is CCCCNC(=O)CNCC(=O)N1CCCCC1.
What is the InChIKey of N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide?
The InChIKey is IEISLIQNHLXECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-2-3-7-15-12(17)10-14-11-13(18)16-8-5-4-6-9-16/h14H,2-11H2,1H3,(H,15,17).
What are the key properties of N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide?
N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide has a molecular weight of 255.36 g/mol, XLogP of 0.50, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide is sourced from PubChem (CID 112685302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).