N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide

C16H27N3O4 — CID 51078601

IUPACN-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
SMILESCC1CN(C(C)CNC(=O)CCN2C(=O)CCC2=O)CC(C)O1
InChIInChI=1S/C16H27N3O4/c1-11(18-9-12(2)23-13(3)10-18)8-17-14(20)6-7-19-15(21)4-5-16(19)22/h11-13H,4-10H2,1-3H3,(H,17,20)
InChIKeyRGGDCFPXNUBCGX-UHFFFAOYSA-N
MW325.41 g/mol
LogP0.14
Rot. Bonds6

About N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide

N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide (PubChem CID 51078601) has the molecular formula C16H27N3O4 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
PubChem CID51078601
Molecular FormulaC16H27N3O4
Molecular Weight325.41 g/mol
Exact Mass325.20
IUPAC NameN-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
SMILESCC1CN(C(C)CNC(=O)CCN2C(=O)CCC2=O)CC(C)O1
InChIInChI=1S/C16H27N3O4/c1-11(18-9-12(2)23-13(3)10-18)8-17-14(20)6-7-19-15(21)4-5-16(19)22/h11-13H,4-10H2,1-3H3,(H,17,20)
InChIKeyRGGDCFPXNUBCGX-UHFFFAOYSA-N
XLogP0.14
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide?
The IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide (CID 51078601) is N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide?
The canonical SMILES for N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide is CC1CN(C(C)CNC(=O)CCN2C(=O)CCC2=O)CC(C)O1.
What is the InChIKey of N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide?
The InChIKey is RGGDCFPXNUBCGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O4/c1-11(18-9-12(2)23-13(3)10-18)8-17-14(20)6-7-19-15(21)4-5-16(19)22/h11-13H,4-10H2,1-3H3,(H,17,20).
What are the key properties of N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide?
N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide has a molecular weight of 325.41 g/mol, XLogP of 0.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide is sourced from PubChem (CID 51078601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).