N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide

C11H23NO5 — CID 91261493

IUPACN,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide
SMILESCCC(=O)N(CCOCCO)CCOCCO
InChIInChI=1S/C11H23NO5/c1-2-11(15)12(3-7-16-9-5-13)4-8-17-10-6-14/h13-14H,2-10H2,1H3
InChIKeyRCDBNXGNMGGYBE-UHFFFAOYSA-N
MW249.31 g/mol
LogP-0.76
Rot. Bonds11

About N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide

N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide (PubChem CID 91261493) has the molecular formula C11H23NO5 and a molecular weight of 249.31 g/mol. Its IUPAC name is N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide.

Molecular Properties

Compound NameN,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide
PubChem CID91261493
Molecular FormulaC11H23NO5
Molecular Weight249.31 g/mol
Exact Mass249.16
IUPAC NameN,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide
SMILESCCC(=O)N(CCOCCO)CCOCCO
InChIInChI=1S/C11H23NO5/c1-2-11(15)12(3-7-16-9-5-13)4-8-17-10-6-14/h13-14H,2-10H2,1H3
InChIKeyRCDBNXGNMGGYBE-UHFFFAOYSA-N
XLogP-0.76
TPSA79.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide?
The IUPAC name of N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide (CID 91261493) is N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide.
What is the SMILES notation for N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide?
The canonical SMILES for N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide is CCC(=O)N(CCOCCO)CCOCCO.
What is the InChIKey of N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide?
The InChIKey is RCDBNXGNMGGYBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO5/c1-2-11(15)12(3-7-16-9-5-13)4-8-17-10-6-14/h13-14H,2-10H2,1H3.
What are the key properties of N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide?
N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide has a molecular weight of 249.31 g/mol, XLogP of -0.76, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide is sourced from PubChem (CID 91261493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).