N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide

C13H23N3O2 — CID 113268579

IUPACN-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide
SMILESO=C(CNCCC(=O)N1CCCCC1)NC1CC1
InChIInChI=1S/C13H23N3O2/c17-12(15-11-4-5-11)10-14-7-6-13(18)16-8-2-1-3-9-16/h11,14H,1-10H2,(H,15,17)
InChIKeyPCBJAVVKBATPRJ-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.26
Rot. Bonds6

About N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide

N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide (PubChem CID 113268579) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide
PubChem CID113268579
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC NameN-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide
SMILESO=C(CNCCC(=O)N1CCCCC1)NC1CC1
InChIInChI=1S/C13H23N3O2/c17-12(15-11-4-5-11)10-14-7-6-13(18)16-8-2-1-3-9-16/h11,14H,1-10H2,(H,15,17)
InChIKeyPCBJAVVKBATPRJ-UHFFFAOYSA-N
XLogP0.26
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.26
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-cyclopropyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide
CID 43401871
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]propanoic acid
CID 43466674
2-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]acetic acid
CID 115581972
N-cycloheptyl-3-oxo-3-pyrrolidin-1-ylpropanamide
CID 108941998
N-cyclohexyl-3-oxo-3-pyrrolidin-1-ylpropanamide
CID 108941929
3-(cyclohexylcarbamoylamino)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
CID 18157282
3-[[2-(cyclohexylamino)-2-oxoethyl]amino]propanamide
CID 43553526
N-butyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide
CID 115586639
N-(2-cyanoethyl)-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide
CID 115586646
N-[1-[3-(ethylamino)propanoyl]piperidin-4-yl]butanamide
CID 62835122
3-[(3-oxo-3-piperidin-1-ylpropyl)amino]propanamide
CID 112685112
4-[[2-(cyclopropylamino)-2-oxoethyl]amino]butanoic acid
CID 43473310

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide (CID 113268579) is N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide is O=C(CNCCC(=O)N1CCCCC1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide?
The InChIKey is PCBJAVVKBATPRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c17-12(15-11-4-5-11)10-14-7-6-13(18)16-8-2-1-3-9-16/h11,14H,1-10H2,(H,15,17).
What are the key properties of N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide?
N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide has a molecular weight of 253.35 g/mol, XLogP of 0.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide is sourced from PubChem (CID 113268579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).