2-(butan-2-yloxymethyl)-N-ethylpentanamide

C12H25NO2 — CID 140571337

IUPAC2-(butan-2-yloxymethyl)-N-ethylpentanamide
SMILESCCCC(COC(C)CC)C(=O)NCC
InChIInChI=1S/C12H25NO2/c1-5-8-11(12(14)13-7-3)9-15-10(4)6-2/h10-11H,5-9H2,1-4H3,(H,13,14)
InChIKeyFFUNOQLMBDVQBP-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.35
Rot. Bonds8

About 2-(butan-2-yloxymethyl)-N-ethylpentanamide

2-(butan-2-yloxymethyl)-N-ethylpentanamide (PubChem CID 140571337) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-(butan-2-yloxymethyl)-N-ethylpentanamide.

Molecular Properties

Compound Name2-(butan-2-yloxymethyl)-N-ethylpentanamide
PubChem CID140571337
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name2-(butan-2-yloxymethyl)-N-ethylpentanamide
SMILESCCCC(COC(C)CC)C(=O)NCC
InChIInChI=1S/C12H25NO2/c1-5-8-11(12(14)13-7-3)9-15-10(4)6-2/h10-11H,5-9H2,1-4H3,(H,13,14)
InChIKeyFFUNOQLMBDVQBP-UHFFFAOYSA-N
XLogP2.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-yloxymethyl)-N-ethylpentanamide?
The IUPAC name of 2-(butan-2-yloxymethyl)-N-ethylpentanamide (CID 140571337) is 2-(butan-2-yloxymethyl)-N-ethylpentanamide.
What is the SMILES notation for 2-(butan-2-yloxymethyl)-N-ethylpentanamide?
The canonical SMILES for 2-(butan-2-yloxymethyl)-N-ethylpentanamide is CCCC(COC(C)CC)C(=O)NCC.
What is the InChIKey of 2-(butan-2-yloxymethyl)-N-ethylpentanamide?
The InChIKey is FFUNOQLMBDVQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-5-8-11(12(14)13-7-3)9-15-10(4)6-2/h10-11H,5-9H2,1-4H3,(H,13,14).
What are the key properties of 2-(butan-2-yloxymethyl)-N-ethylpentanamide?
2-(butan-2-yloxymethyl)-N-ethylpentanamide has a molecular weight of 215.34 g/mol, XLogP of 2.35, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-yloxymethyl)-N-ethylpentanamide is sourced from PubChem (CID 140571337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).