3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide

C11H23N3O3 — CID 113226661

IUPAC3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide
SMILESCCN(CC)C(=O)NCCC(=O)NCCOC
InChIInChI=1S/C11H23N3O3/c1-4-14(5-2)11(16)13-7-6-10(15)12-8-9-17-3/h4-9H2,1-3H3,(H,12,15)(H,13,16)
InChIKeyXTHFBERKMFJTLH-UHFFFAOYSA-N
MW245.32 g/mol
LogP0.19
Rot. Bonds8

About 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide

3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide (PubChem CID 113226661) has the molecular formula C11H23N3O3 and a molecular weight of 245.32 g/mol. Its IUPAC name is 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide
PubChem CID113226661
Molecular FormulaC11H23N3O3
Molecular Weight245.32 g/mol
Exact Mass245.17
IUPAC Name3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide
SMILESCCN(CC)C(=O)NCCC(=O)NCCOC
InChIInChI=1S/C11H23N3O3/c1-4-14(5-2)11(16)13-7-6-10(15)12-8-9-17-3/h4-9H2,1-3H3,(H,12,15)(H,13,16)
InChIKeyXTHFBERKMFJTLH-UHFFFAOYSA-N
XLogP0.19
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(2-methoxyethylamino)-3-oxopropyl]butanamide
CID 115590611
N-[2-(diethylcarbamoylamino)ethyl]-2-(2-methoxyethoxy)acetamide
CID 108574836
N-(2-methoxyethyl)-3-(3-sulfanylpropanoylamino)propanamide
CID 107034705
N-(2-methoxyethyl)-3-(methylamino)propanamide
CID 43827811
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
2-methoxy-N-[3-(2-methoxyethylamino)-3-oxopropyl]propanamide
CID 112686354
5-methoxy-N-(2-methoxyethyl)pentanamide
CID 58281484
N-butan-2-yl-3-(diethylcarbamoylamino)propanamide
CID 115589357
2-[ethylcarbamoyl(methyl)amino]-N-(2-methoxyethyl)acetamide
CID 47128037
2-cyano-N-[3-(2-methoxyethylamino)-3-oxopropyl]pentanamide
CID 113410594
2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111037001
3-(heptan-4-ylamino)-N-(2-methoxyethyl)propanamide
CID 115676517

Frequently Asked Questions

What is the IUPAC name of 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide?
The IUPAC name of 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide (CID 113226661) is 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide is CCN(CC)C(=O)NCCC(=O)NCCOC.
What is the InChIKey of 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide?
The InChIKey is XTHFBERKMFJTLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3/c1-4-14(5-2)11(16)13-7-6-10(15)12-8-9-17-3/h4-9H2,1-3H3,(H,12,15)(H,13,16).
What are the key properties of 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide?
3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide has a molecular weight of 245.32 g/mol, XLogP of 0.19, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 113226661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).