N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide

C10H20N2O5 — CID 163884535

IUPACN-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide
SMILESCOCNC(=O)CCOCCC(=O)NCOC
InChIInChI=1S/C10H20N2O5/c1-15-7-11-9(13)3-5-17-6-4-10(14)12-8-16-2/h3-8H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyPWESNNDWVSSAPT-UHFFFAOYSA-N
MW248.28 g/mol
LogP-0.78
Rot. Bonds10

About N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide

N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide (PubChem CID 163884535) has the molecular formula C10H20N2O5 and a molecular weight of 248.28 g/mol. Its IUPAC name is N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide.

Molecular Properties

Compound NameN-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide
PubChem CID163884535
Molecular FormulaC10H20N2O5
Molecular Weight248.28 g/mol
Exact Mass248.14
IUPAC NameN-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide
SMILESCOCNC(=O)CCOCCC(=O)NCOC
InChIInChI=1S/C10H20N2O5/c1-15-7-11-9(13)3-5-17-6-4-10(14)12-8-16-2/h3-8H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyPWESNNDWVSSAPT-UHFFFAOYSA-N
XLogP-0.78
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

[3-(methoxymethylamino)-3-oxopropyl] carbamate
CID 22489108
4-(methoxymethylamino)-4-oxobutanoic acid
CID 121230669
3-[2-[2-[2-(ethylamino)ethoxy]ethoxy]ethoxy]-N-(2-methoxyethoxymethyl)propanamide
CID 177055745
3-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]propanehydrazide
CID 118988091
3-methoxy-N-[2-[2-[2-(3-methoxypropanoylamino)ethoxy]ethoxy]ethyl]propanamide
CID 166969109
N-[2-[(2-methoxyacetyl)amino]ethyl]-3-(2-methoxyethoxy)propanamide
CID 59805161
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-methylpropanamide
CID 129207576
3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide
CID 58019725
3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-N-[2-(3-sulfanylpropanoylamino)ethyl]propanamide
CID 101361634
N-(methoxymethyl)hexadecanamide
CID 59805196
N-[2-(ethylamino)ethyl]-3-(2-methoxyethoxy)propanamide
CID 119508820
N-ethyl-3-[2-(2-propoxyethoxy)ethoxy]propanamide
CID 144855445

Frequently Asked Questions

What is the IUPAC name of N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide?
The IUPAC name of N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide (CID 163884535) is N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide.
What is the SMILES notation for N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide?
The canonical SMILES for N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide is COCNC(=O)CCOCCC(=O)NCOC.
What is the InChIKey of N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide?
The InChIKey is PWESNNDWVSSAPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O5/c1-15-7-11-9(13)3-5-17-6-4-10(14)12-8-16-2/h3-8H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide?
N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide has a molecular weight of 248.28 g/mol, XLogP of -0.78, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methoxymethyl)-3-[3-(methoxymethylamino)-3-oxopropoxy]propanamide is sourced from PubChem (CID 163884535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).