N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide

C11H22N2O4 — CID 163393368

IUPACN-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide
SMILESCCC(=O)NCCOCCOCCC(=O)NC
InChIInChI=1S/C11H22N2O4/c1-3-10(14)13-5-7-17-9-8-16-6-4-11(15)12-2/h3-9H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyNNCVOTPOAKANDR-UHFFFAOYSA-N
MW246.31 g/mol
LogP-0.32
Rot. Bonds10

About N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide

N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide (PubChem CID 163393368) has the molecular formula C11H22N2O4 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide.

Molecular Properties

Compound NameN-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide
PubChem CID163393368
Molecular FormulaC11H22N2O4
Molecular Weight246.31 g/mol
Exact Mass246.16
IUPAC NameN-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide
SMILESCCC(=O)NCCOCCOCCC(=O)NC
InChIInChI=1S/C11H22N2O4/c1-3-10(14)13-5-7-17-9-8-16-6-4-11(15)12-2/h3-9H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyNNCVOTPOAKANDR-UHFFFAOYSA-N
XLogP-0.32
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 5-0.32
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

N-[2-(3-oxobutoxy)ethyl]propanamide
CID 170259518
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]propanamide
CID 122664379
N-methyl-N'-[2-(2-propoxyethoxy)ethyl]pentanediamide
CID 176584959
N-[2-[2-[2-[2-(propanoylamino)ethoxy]ethoxy]ethoxy]ethyl]pentanamide
CID 167513156
N-[2-(2-butoxyethoxy)ethyl]propanamide
CID 153105198
N-[2-[2-[2-(ethylamino)ethoxy]ethoxy]ethyl]propanamide
CID 147425516
N-[2-[2-(2-bromoethoxy)ethoxy]ethyl]propanamide
CID 154729990
3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide
CID 58019725
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
methyl 4-[2-[2-[2-[2-[2-[2-(propanoylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoate
CID 175294176
2-[2-[2-[3-(methylamino)-3-oxopropoxy]ethoxy]ethoxy]ethyl N-[2-[2-[2-[2-(3-amino-3-oxopropoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate
CID 138748213
molecular hydrogen;N-(2-propoxyethyl)propanamide
CID 170639851

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide?
The IUPAC name of N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide (CID 163393368) is N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide.
What is the SMILES notation for N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide?
The canonical SMILES for N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide is CCC(=O)NCCOCCOCCC(=O)NC.
What is the InChIKey of N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide?
The InChIKey is NNCVOTPOAKANDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4/c1-3-10(14)13-5-7-17-9-8-16-6-4-11(15)12-2/h3-9H2,1-2H3,(H,12,15)(H,13,14).
What are the key properties of N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide?
N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide has a molecular weight of 246.31 g/mol, XLogP of -0.32, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide is sourced from PubChem (CID 163393368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).