2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide

C14H28N4O3 — CID 128975039

IUPAC2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide
SMILESCCC(C(=O)N1CCOC(CN(C)CC(N)=O)C1)N(C)C
InChIInChI=1S/C14H28N4O3/c1-5-12(16(2)3)14(20)18-6-7-21-11(9-18)8-17(4)10-13(15)19/h11-12H,5-10H2,1-4H3,(H2,15,19)
InChIKeyGZTVDDVGRIAQRR-UHFFFAOYSA-N
MW300.40 g/mol
LogP-1.03
Rot. Bonds7

About 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide

2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide (PubChem CID 128975039) has the molecular formula C14H28N4O3 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide.

Molecular Properties

Compound Name2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide
PubChem CID128975039
Molecular FormulaC14H28N4O3
Molecular Weight300.40 g/mol
Exact Mass300.22
IUPAC Name2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide
SMILESCCC(C(=O)N1CCOC(CN(C)CC(N)=O)C1)N(C)C
InChIInChI=1S/C14H28N4O3/c1-5-12(16(2)3)14(20)18-6-7-21-11(9-18)8-17(4)10-13(15)19/h11-12H,5-10H2,1-4H3,(H2,15,19)
InChIKeyGZTVDDVGRIAQRR-UHFFFAOYSA-N
XLogP-1.03
TPSA79.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 5-1.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide?
The IUPAC name of 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide (CID 128975039) is 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide.
What is the SMILES notation for 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide?
The canonical SMILES for 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide is CCC(C(=O)N1CCOC(CN(C)CC(N)=O)C1)N(C)C.
What is the InChIKey of 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide?
The InChIKey is GZTVDDVGRIAQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O3/c1-5-12(16(2)3)14(20)18-6-7-21-11(9-18)8-17(4)10-13(15)19/h11-12H,5-10H2,1-4H3,(H2,15,19).
What are the key properties of 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide?
2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide has a molecular weight of 300.40 g/mol, XLogP of -1.03, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-[2-(dimethylamino)butanoyl]morpholin-2-yl]methyl-methylamino]acetamide is sourced from PubChem (CID 128975039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).