1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide

C15H26N2O3 — CID 113003322

IUPAC1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide
SMILESCOCCCNC(=O)C1CCN(C(=O)C2CCC2)CC1
InChIInChI=1S/C15H26N2O3/c1-20-11-3-8-16-14(18)12-6-9-17(10-7-12)15(19)13-4-2-5-13/h12-13H,2-11H2,1H3,(H,16,18)
InChIKeyQVKPKAGJZSSSAG-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.18
Rot. Bonds6

About 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide

1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide (PubChem CID 113003322) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide
PubChem CID113003322
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide
SMILESCOCCCNC(=O)C1CCN(C(=O)C2CCC2)CC1
InChIInChI=1S/C15H26N2O3/c1-20-11-3-8-16-14(18)12-6-9-17(10-7-12)15(19)13-4-2-5-13/h12-13H,2-11H2,1H3,(H,16,18)
InChIKeyQVKPKAGJZSSSAG-UHFFFAOYSA-N
XLogP1.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide?
The IUPAC name of 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide (CID 113003322) is 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide is COCCCNC(=O)C1CCN(C(=O)C2CCC2)CC1.
What is the InChIKey of 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide?
The InChIKey is QVKPKAGJZSSSAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-20-11-3-8-16-14(18)12-6-9-17(10-7-12)15(19)13-4-2-5-13/h12-13H,2-11H2,1H3,(H,16,18).
What are the key properties of 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide?
1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide has a molecular weight of 282.38 g/mol, XLogP of 1.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutanecarbonyl)-N-(3-methoxypropyl)piperidine-4-carboxamide is sourced from PubChem (CID 113003322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).