4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione

C17H30N2O2 — CID 79575767

IUPAC4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione
SMILESCCCNC1CCCC1CCN1C(=O)CC(C)(C)CC1=O
InChIInChI=1S/C17H30N2O2/c1-4-9-18-14-7-5-6-13(14)8-10-19-15(20)11-17(2,3)12-16(19)21/h13-14,18H,4-12H2,1-3H3
InChIKeyHTPQGTPMQHRWQB-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.72
Rot. Bonds6

About 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione

4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione (PubChem CID 79575767) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione.

Molecular Properties

Compound Name4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione
PubChem CID79575767
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione
SMILESCCCNC1CCCC1CCN1C(=O)CC(C)(C)CC1=O
InChIInChI=1S/C17H30N2O2/c1-4-9-18-14-7-5-6-13(14)8-10-19-15(20)11-17(2,3)12-16(19)21/h13-14,18H,4-12H2,1-3H3
InChIKeyHTPQGTPMQHRWQB-UHFFFAOYSA-N
XLogP2.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.72
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 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione?
The IUPAC name of 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione (CID 79575767) is 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione.
What is the SMILES notation for 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione?
The canonical SMILES for 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione is CCCNC1CCCC1CCN1C(=O)CC(C)(C)CC1=O.
What is the InChIKey of 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione?
The InChIKey is HTPQGTPMQHRWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-4-9-18-14-7-5-6-13(14)8-10-19-15(20)11-17(2,3)12-16(19)21/h13-14,18H,4-12H2,1-3H3.
What are the key properties of 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione?
4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione has a molecular weight of 294.44 g/mol, XLogP of 2.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-1-[2-[2-(propylamino)cyclopentyl]ethyl]piperidine-2,6-dione is sourced from PubChem (CID 79575767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).