N,N'-bis(3-piperidin-1-ylpropyl)oxamide

C18H34N4O2 — CID 46734046

IUPACN,N'-bis(3-piperidin-1-ylpropyl)oxamide
SMILESO=C(NCCCN1CCCCC1)C(=O)NCCCN1CCCCC1
InChIInChI=1S/C18H34N4O2/c23-17(19-9-7-15-21-11-3-1-4-12-21)18(24)20-10-8-16-22-13-5-2-6-14-22/h1-16H2,(H,19,23)(H,20,24)
InChIKeyNLUZJDRJVPDTTP-UHFFFAOYSA-N
MW338.50 g/mol
LogP0.97
Rot. Bonds8

About N,N'-bis(3-piperidin-1-ylpropyl)oxamide

N,N'-bis(3-piperidin-1-ylpropyl)oxamide (PubChem CID 46734046) has the molecular formula C18H34N4O2 and a molecular weight of 338.50 g/mol. Its IUPAC name is N,N'-bis(3-piperidin-1-ylpropyl)oxamide.

Molecular Properties

Compound NameN,N'-bis(3-piperidin-1-ylpropyl)oxamide
PubChem CID46734046
Molecular FormulaC18H34N4O2
Molecular Weight338.50 g/mol
Exact Mass338.27
IUPAC NameN,N'-bis(3-piperidin-1-ylpropyl)oxamide
SMILESO=C(NCCCN1CCCCC1)C(=O)NCCCN1CCCCC1
InChIInChI=1S/C18H34N4O2/c23-17(19-9-7-15-21-11-3-1-4-12-21)18(24)20-10-8-16-22-13-5-2-6-14-22/h1-16H2,(H,19,23)(H,20,24)
InChIKeyNLUZJDRJVPDTTP-UHFFFAOYSA-N
XLogP0.97
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(3-piperidin-1-ylpropyl)oxamide?
The IUPAC name of N,N'-bis(3-piperidin-1-ylpropyl)oxamide (CID 46734046) is N,N'-bis(3-piperidin-1-ylpropyl)oxamide.
What is the SMILES notation for N,N'-bis(3-piperidin-1-ylpropyl)oxamide?
The canonical SMILES for N,N'-bis(3-piperidin-1-ylpropyl)oxamide is O=C(NCCCN1CCCCC1)C(=O)NCCCN1CCCCC1.
What is the InChIKey of N,N'-bis(3-piperidin-1-ylpropyl)oxamide?
The InChIKey is NLUZJDRJVPDTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N4O2/c23-17(19-9-7-15-21-11-3-1-4-12-21)18(24)20-10-8-16-22-13-5-2-6-14-22/h1-16H2,(H,19,23)(H,20,24).
What are the key properties of N,N'-bis(3-piperidin-1-ylpropyl)oxamide?
N,N'-bis(3-piperidin-1-ylpropyl)oxamide has a molecular weight of 338.50 g/mol, XLogP of 0.97, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(3-piperidin-1-ylpropyl)oxamide is sourced from PubChem (CID 46734046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).