4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione

C14H26N2O2 — CID 79506645

IUPAC4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione
SMILESCCCNC(CCC)CN1C(=O)CC(C)CC1=O
InChIInChI=1S/C14H26N2O2/c1-4-6-12(15-7-5-2)10-16-13(17)8-11(3)9-14(16)18/h11-12,15H,4-10H2,1-3H3
InChIKeyPJWCJLFMONNYTD-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.94
Rot. Bonds7

About 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione

4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione (PubChem CID 79506645) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione.

Molecular Properties

Compound Name4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione
PubChem CID79506645
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione
SMILESCCCNC(CCC)CN1C(=O)CC(C)CC1=O
InChIInChI=1S/C14H26N2O2/c1-4-6-12(15-7-5-2)10-16-13(17)8-11(3)9-14(16)18/h11-12,15H,4-10H2,1-3H3
InChIKeyPJWCJLFMONNYTD-UHFFFAOYSA-N
XLogP1.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione?
The IUPAC name of 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione (CID 79506645) is 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione.
What is the SMILES notation for 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione?
The canonical SMILES for 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione is CCCNC(CCC)CN1C(=O)CC(C)CC1=O.
What is the InChIKey of 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione?
The InChIKey is PJWCJLFMONNYTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-4-6-12(15-7-5-2)10-16-13(17)8-11(3)9-14(16)18/h11-12,15H,4-10H2,1-3H3.
What are the key properties of 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione?
4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione has a molecular weight of 254.37 g/mol, XLogP of 1.94, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione is sourced from PubChem (CID 79506645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).