2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide

C11H23N3O2 — CID 119841025

IUPAC2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide
SMILESCC1CN(CCCNC(=O)CN)CC(C)O1
InChIInChI=1S/C11H23N3O2/c1-9-7-14(8-10(2)16-9)5-3-4-13-11(15)6-12/h9-10H,3-8,12H2,1-2H3,(H,13,15)
InChIKeyTTZHQCRNAUPLTA-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.44
Rot. Bonds5

About 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide

2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide (PubChem CID 119841025) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide
PubChem CID119841025
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide
SMILESCC1CN(CCCNC(=O)CN)CC(C)O1
InChIInChI=1S/C11H23N3O2/c1-9-7-14(8-10(2)16-9)5-3-4-13-11(15)6-12/h9-10H,3-8,12H2,1-2H3,(H,13,15)
InChIKeyTTZHQCRNAUPLTA-UHFFFAOYSA-N
XLogP-0.44
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide?
The IUPAC name of 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide (CID 119841025) is 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide.
What is the SMILES notation for 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide?
The canonical SMILES for 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide is CC1CN(CCCNC(=O)CN)CC(C)O1.
What is the InChIKey of 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide?
The InChIKey is TTZHQCRNAUPLTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-9-7-14(8-10(2)16-9)5-3-4-13-11(15)6-12/h9-10H,3-8,12H2,1-2H3,(H,13,15).
What are the key properties of 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide?
2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide has a molecular weight of 229.32 g/mol, XLogP of -0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide is sourced from PubChem (CID 119841025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).