N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide

C10H19N3O3 — CID 3126762

IUPACN-methyl-N'-(3-morpholin-4-ylpropyl)oxamide
SMILESCNC(=O)C(=O)NCCCN1CCOCC1
InChIInChI=1S/C10H19N3O3/c1-11-9(14)10(15)12-3-2-4-13-5-7-16-8-6-13/h2-8H2,1H3,(H,11,14)(H,12,15)
InChIKeyPNKXJDSLOFRXGR-UHFFFAOYSA-N
MW229.28 g/mol
LogP-1.43
Rot. Bonds4

About N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide

N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide (PubChem CID 3126762) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide.

Molecular Properties

Compound NameN-methyl-N'-(3-morpholin-4-ylpropyl)oxamide
PubChem CID3126762
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC NameN-methyl-N'-(3-morpholin-4-ylpropyl)oxamide
SMILESCNC(=O)C(=O)NCCCN1CCOCC1
InChIInChI=1S/C10H19N3O3/c1-11-9(14)10(15)12-3-2-4-13-5-7-16-8-6-13/h2-8H2,1H3,(H,11,14)(H,12,15)
InChIKeyPNKXJDSLOFRXGR-UHFFFAOYSA-N
XLogP-1.43
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-1.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide?
The IUPAC name of N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide (CID 3126762) is N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide.
What is the SMILES notation for N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide?
The canonical SMILES for N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide is CNC(=O)C(=O)NCCCN1CCOCC1.
What is the InChIKey of N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide?
The InChIKey is PNKXJDSLOFRXGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-11-9(14)10(15)12-3-2-4-13-5-7-16-8-6-13/h2-8H2,1H3,(H,11,14)(H,12,15).
What are the key properties of N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide?
N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide has a molecular weight of 229.28 g/mol, XLogP of -1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N'-(3-morpholin-4-ylpropyl)oxamide is sourced from PubChem (CID 3126762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).