2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide

C11H20N4O4 — CID 123676891

IUPAC2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide
SMILESCC(NC(=O)CNC(=O)CN1CCOCC1)C(N)=O
InChIInChI=1S/C11H20N4O4/c1-8(11(12)18)14-9(16)6-13-10(17)7-15-2-4-19-5-3-15/h8H,2-7H2,1H3,(H2,12,18)(H,13,17)(H,14,16)
InChIKeyUQKMFXUKPABIGM-UHFFFAOYSA-N
MW272.30 g/mol
LogP-2.58
Rot. Bonds6

About 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide

2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide (PubChem CID 123676891) has the molecular formula C11H20N4O4 and a molecular weight of 272.30 g/mol. Its IUPAC name is 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide.

Molecular Properties

Compound Name2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide
PubChem CID123676891
Molecular FormulaC11H20N4O4
Molecular Weight272.30 g/mol
Exact Mass272.15
IUPAC Name2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide
SMILESCC(NC(=O)CNC(=O)CN1CCOCC1)C(N)=O
InChIInChI=1S/C11H20N4O4/c1-8(11(12)18)14-9(16)6-13-10(17)7-15-2-4-19-5-3-15/h8H,2-7H2,1H3,(H2,12,18)(H,13,17)(H,14,16)
InChIKeyUQKMFXUKPABIGM-UHFFFAOYSA-N
XLogP-2.58
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 5-2.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide?
The IUPAC name of 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide (CID 123676891) is 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide.
What is the SMILES notation for 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide?
The canonical SMILES for 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide is CC(NC(=O)CNC(=O)CN1CCOCC1)C(N)=O.
What is the InChIKey of 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide?
The InChIKey is UQKMFXUKPABIGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O4/c1-8(11(12)18)14-9(16)6-13-10(17)7-15-2-4-19-5-3-15/h8H,2-7H2,1H3,(H2,12,18)(H,13,17)(H,14,16).
What are the key properties of 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide?
2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide has a molecular weight of 272.30 g/mol, XLogP of -2.58, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide is sourced from PubChem (CID 123676891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).