2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide

C10H17N3O4 — CID 173077949

IUPAC2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide
SMILESCC(C(N)=O)C(=O)NC(=O)CN1CCOCC1
InChIInChI=1S/C10H17N3O4/c1-7(9(11)15)10(16)12-8(14)6-13-2-4-17-5-3-13/h7H,2-6H2,1H3,(H2,11,15)(H,12,14,16)
InChIKeyQRQQNTOUWUFELE-UHFFFAOYSA-N
MW243.26 g/mol
LogP-1.92
Rot. Bonds4

About 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide

2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide (PubChem CID 173077949) has the molecular formula C10H17N3O4 and a molecular weight of 243.26 g/mol. Its IUPAC name is 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide.

Molecular Properties

Compound Name2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide
PubChem CID173077949
Molecular FormulaC10H17N3O4
Molecular Weight243.26 g/mol
Exact Mass243.12
IUPAC Name2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide
SMILESCC(C(N)=O)C(=O)NC(=O)CN1CCOCC1
InChIInChI=1S/C10H17N3O4/c1-7(9(11)15)10(16)12-8(14)6-13-2-4-17-5-3-13/h7H,2-6H2,1H3,(H2,11,15)(H,12,14,16)
InChIKeyQRQQNTOUWUFELE-UHFFFAOYSA-N
XLogP-1.92
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 5-1.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

2-[[2-[(2-morpholin-4-ylacetyl)amino]acetyl]amino]propanamide
CID 123676891
ethane;N-methyl-2-morpholin-4-ylacetamide
CID 143296562
N-(4-hydroxybutan-2-yl)-2-morpholin-4-ylacetamide
CID 110011691
N'-methyl-2-morpholin-4-ylacetohydrazide
CID 142817300
potassium (2S)-2-[(2-morpholin-4-ylacetyl)amino]propanoate
CID 131737033
(2S)-4-methyl-2-[(2-morpholin-4-ylacetyl)amino]pentanoic acid
CID 90040549
2-morpholin-4-yl-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 86019043
3-methyl-N-[[3-methyl-1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]carbamoyl]-2-[(2-morpholin-4-ylacetyl)carbamoylamino]butanamide
CID 167262544
methyl 2-morpholin-4-ylacetate
CID 1268178
1,3-dimorpholin-4-ylpropan-2-one
CID 139559066
N'-(2-chloroacetyl)-2-morpholin-4-ylacetohydrazide
CID 23544064
N-(1,4-dimethylpiperidin-4-yl)-2-morpholin-4-ylacetamide
CID 142326973

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide?
The IUPAC name of 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide (CID 173077949) is 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide.
What is the SMILES notation for 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide?
The canonical SMILES for 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide is CC(C(N)=O)C(=O)NC(=O)CN1CCOCC1.
What is the InChIKey of 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide?
The InChIKey is QRQQNTOUWUFELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O4/c1-7(9(11)15)10(16)12-8(14)6-13-2-4-17-5-3-13/h7H,2-6H2,1H3,(H2,11,15)(H,12,14,16).
What are the key properties of 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide?
2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide has a molecular weight of 243.26 g/mol, XLogP of -1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-(2-morpholin-4-ylacetyl)propanediamide is sourced from PubChem (CID 173077949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).