3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide

C9H21N3O2 — CID 62844322

IUPAC3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide
SMILESCOCCN(C)CCNCCC(N)=O
InChIInChI=1S/C9H21N3O2/c1-12(7-8-14-2)6-5-11-4-3-9(10)13/h11H,3-8H2,1-2H3,(H2,10,13)
InChIKeyMZGXBBPVOLLVSM-UHFFFAOYSA-N
MW203.29 g/mol
LogP-0.97
Rot. Bonds9

About 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide

3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide (PubChem CID 62844322) has the molecular formula C9H21N3O2 and a molecular weight of 203.29 g/mol. Its IUPAC name is 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide.

Molecular Properties

Compound Name3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide
PubChem CID62844322
Molecular FormulaC9H21N3O2
Molecular Weight203.29 g/mol
Exact Mass203.16
IUPAC Name3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide
SMILESCOCCN(C)CCNCCC(N)=O
InChIInChI=1S/C9H21N3O2/c1-12(7-8-14-2)6-5-11-4-3-9(10)13/h11H,3-8H2,1-2H3,(H2,10,13)
InChIKeyMZGXBBPVOLLVSM-UHFFFAOYSA-N
XLogP-0.97
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 5-0.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[2-[2-methoxyethyl(methyl)amino]ethylamino]-N,N-dimethylbutanamide
CID 62843976
N'-hydroxy-4-[2-[2-methoxyethyl(methyl)amino]ethylamino]butanimidamide
CID 77030327
3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-2-methylpropanamide
CID 62843100
N-(2-fluoroethyl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 80695332
methyl 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]-2,2-dimethylpropanoate
CID 79623662
N-ethyl-2-[2-[2-methoxyethyl(methyl)amino]ethylamino]-N-methylacetamide
CID 62843102
N-(3,3-dimethylbutyl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 62557559
3-[2-[benzyl(methyl)amino]ethylamino]propanamide
CID 130877851
3-[2-[bis(2-methoxyethyl)amino]ethylamino]propanoic acid
CID 166790089
N-heptyl-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 62844812
3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanenitrile
CID 62843290
N'-(2-methoxyethyl)-N'-methyl-N-(2-methylpropyl)ethane-1,2-diamine
CID 62448029

Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide?
The IUPAC name of 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide (CID 62844322) is 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide.
What is the SMILES notation for 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide?
The canonical SMILES for 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide is COCCN(C)CCNCCC(N)=O.
What is the InChIKey of 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide?
The InChIKey is MZGXBBPVOLLVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2/c1-12(7-8-14-2)6-5-11-4-3-9(10)13/h11H,3-8H2,1-2H3,(H2,10,13).
What are the key properties of 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide?
3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide has a molecular weight of 203.29 g/mol, XLogP of -0.97, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-methoxyethyl(methyl)amino]ethylamino]propanamide is sourced from PubChem (CID 62844322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).