N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide

C12H23N3O2 — CID 43397981

IUPACN-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide
SMILESCC(=O)NCCNC(C)C(=O)N1CCCCC1
InChIInChI=1S/C12H23N3O2/c1-10(13-6-7-14-11(2)16)12(17)15-8-4-3-5-9-15/h10,13H,3-9H2,1-2H3,(H,14,16)
InChIKeyNDYKJXFHLNNTGX-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.11
Rot. Bonds5

About N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide

N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide (PubChem CID 43397981) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide
PubChem CID43397981
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide
SMILESCC(=O)NCCNC(C)C(=O)N1CCCCC1
InChIInChI=1S/C12H23N3O2/c1-10(13-6-7-14-11(2)16)12(17)15-8-4-3-5-9-15/h10,13H,3-9H2,1-2H3,(H,14,16)
InChIKeyNDYKJXFHLNNTGX-UHFFFAOYSA-N
XLogP0.11
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.11
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-[2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]ethyl]acetamide
CID 43397982
1-(azepan-1-yl)-2-(butylamino)propan-1-one
CID 43086925
N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]methanesulfonamide
CID 43545989
2-(5-hydroxypentylamino)-1-piperidin-1-ylpropan-1-one
CID 113408435
N-(2-acetamidoethyl)piperidine-1-carboxamide
CID 115575266
(2R)-2-(2-methoxyethylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 7437225
5-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]pentanoic acid
CID 103262840
1-piperidin-1-yl-2-(5,5,5-trifluoropentylamino)propan-1-one
CID 115518643
2-(2-morpholin-4-ylethylamino)-1-piperidin-1-ylpropan-1-one
CID 43083600
2-(2-hydroxypropylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 43389372
2-(3-methylbut-2-enylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 103520472
2-[[1-(azepan-1-yl)-1-oxopropan-2-yl]amino]-N-propan-2-ylacetamide
CID 43402044

Frequently Asked Questions

What is the IUPAC name of N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide?
The IUPAC name of N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide (CID 43397981) is N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide.
What is the SMILES notation for N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide?
The canonical SMILES for N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide is CC(=O)NCCNC(C)C(=O)N1CCCCC1.
What is the InChIKey of N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide?
The InChIKey is NDYKJXFHLNNTGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-10(13-6-7-14-11(2)16)12(17)15-8-4-3-5-9-15/h10,13H,3-9H2,1-2H3,(H,14,16).
What are the key properties of N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide?
N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide has a molecular weight of 241.33 g/mol, XLogP of 0.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]ethyl]acetamide is sourced from PubChem (CID 43397981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).