N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide

C14H28N2O4 — CID 89037469

IUPACN-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide
SMILESCC(C)C(=O)NC(C)(C)C(=O)NC(C)C(C)OCCO
InChIInChI=1S/C14H28N2O4/c1-9(2)12(18)16-14(5,6)13(19)15-10(3)11(4)20-8-7-17/h9-11,17H,7-8H2,1-6H3,(H,15,19)(H,16,18)
InChIKeyUOAZRFPZIWPIPS-UHFFFAOYSA-N
MW288.39 g/mol
LogP0.44
Rot. Bonds8

About N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide

N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide (PubChem CID 89037469) has the molecular formula C14H28N2O4 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide.

Molecular Properties

Compound NameN-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide
PubChem CID89037469
Molecular FormulaC14H28N2O4
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide
SMILESCC(C)C(=O)NC(C)(C)C(=O)NC(C)C(C)OCCO
InChIInChI=1S/C14H28N2O4/c1-9(2)12(18)16-14(5,6)13(19)15-10(3)11(4)20-8-7-17/h9-11,17H,7-8H2,1-6H3,(H,15,19)(H,16,18)
InChIKeyUOAZRFPZIWPIPS-UHFFFAOYSA-N
XLogP0.44
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 50.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide?
The IUPAC name of N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide (CID 89037469) is N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide.
What is the SMILES notation for N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide?
The canonical SMILES for N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide is CC(C)C(=O)NC(C)(C)C(=O)NC(C)C(C)OCCO.
What is the InChIKey of N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide?
The InChIKey is UOAZRFPZIWPIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O4/c1-9(2)12(18)16-14(5,6)13(19)15-10(3)11(4)20-8-7-17/h9-11,17H,7-8H2,1-6H3,(H,15,19)(H,16,18).
What are the key properties of N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide?
N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide has a molecular weight of 288.39 g/mol, XLogP of 0.44, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-hydroxyethoxy)butan-2-yl]-2-methyl-2-(2-methylpropanoylamino)propanamide is sourced from PubChem (CID 89037469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).