N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide

C11H23NO3 — CID 103274835

IUPACN-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide
SMILESCCOCC(NC(=O)C(C)OC)C(C)C
InChIInChI=1S/C11H23NO3/c1-6-15-7-10(8(2)3)12-11(13)9(4)14-5/h8-10H,6-7H2,1-5H3,(H,12,13)
InChIKeyZPHOUDLPBXKCBG-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.20
Rot. Bonds7

About N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide

N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide (PubChem CID 103274835) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide.

Molecular Properties

Compound NameN-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide
PubChem CID103274835
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC NameN-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide
SMILESCCOCC(NC(=O)C(C)OC)C(C)C
InChIInChI=1S/C11H23NO3/c1-6-15-7-10(8(2)3)12-11(13)9(4)14-5/h8-10H,6-7H2,1-5H3,(H,12,13)
InChIKeyZPHOUDLPBXKCBG-UHFFFAOYSA-N
XLogP1.20
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide?
The IUPAC name of N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide (CID 103274835) is N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide.
What is the SMILES notation for N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide?
The canonical SMILES for N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide is CCOCC(NC(=O)C(C)OC)C(C)C.
What is the InChIKey of N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide?
The InChIKey is ZPHOUDLPBXKCBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-6-15-7-10(8(2)3)12-11(13)9(4)14-5/h8-10H,6-7H2,1-5H3,(H,12,13).
What are the key properties of N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide?
N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide has a molecular weight of 217.31 g/mol, XLogP of 1.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide is sourced from PubChem (CID 103274835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).