N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide

C12H23NO3 — CID 109468260

IUPACN-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide
SMILESCCN(CCO)C(=O)CCC1CCC(C)O1
InChIInChI=1S/C12H23NO3/c1-3-13(8-9-14)12(15)7-6-11-5-4-10(2)16-11/h10-11,14H,3-9H2,1-2H3
InChIKeyRCCLGXYPQMOVHS-UHFFFAOYSA-N
MW229.32 g/mol
LogP1.17
Rot. Bonds6

About N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide

N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide (PubChem CID 109468260) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide
PubChem CID109468260
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC NameN-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide
SMILESCCN(CCO)C(=O)CCC1CCC(C)O1
InChIInChI=1S/C12H23NO3/c1-3-13(8-9-14)12(15)7-6-11-5-4-10(2)16-11/h10-11,14H,3-9H2,1-2H3
InChIKeyRCCLGXYPQMOVHS-UHFFFAOYSA-N
XLogP1.17
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide?
The IUPAC name of N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide (CID 109468260) is N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide.
What is the SMILES notation for N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide?
The canonical SMILES for N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide is CCN(CCO)C(=O)CCC1CCC(C)O1.
What is the InChIKey of N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide?
The InChIKey is RCCLGXYPQMOVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c1-3-13(8-9-14)12(15)7-6-11-5-4-10(2)16-11/h10-11,14H,3-9H2,1-2H3.
What are the key properties of N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide?
N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide has a molecular weight of 229.32 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide is sourced from PubChem (CID 109468260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).