3-cyclopropyl-N-ethyl-2-propoxypropanamide

C11H21NO2 — CID 89093015

IUPAC3-cyclopropyl-N-ethyl-2-propoxypropanamide
SMILESCCCOC(CC1CC1)C(=O)NCC
InChIInChI=1S/C11H21NO2/c1-3-7-14-10(8-9-5-6-9)11(13)12-4-2/h9-10H,3-8H2,1-2H3,(H,12,13)
InChIKeyYCQBKPOTVYCYPX-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.72
Rot. Bonds7

About 3-cyclopropyl-N-ethyl-2-propoxypropanamide

3-cyclopropyl-N-ethyl-2-propoxypropanamide (PubChem CID 89093015) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 3-cyclopropyl-N-ethyl-2-propoxypropanamide.

Molecular Properties

Compound Name3-cyclopropyl-N-ethyl-2-propoxypropanamide
PubChem CID89093015
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name3-cyclopropyl-N-ethyl-2-propoxypropanamide
SMILESCCCOC(CC1CC1)C(=O)NCC
InChIInChI=1S/C11H21NO2/c1-3-7-14-10(8-9-5-6-9)11(13)12-4-2/h9-10H,3-8H2,1-2H3,(H,12,13)
InChIKeyYCQBKPOTVYCYPX-UHFFFAOYSA-N
XLogP1.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-ethyl-2-propoxypropanamide?
The IUPAC name of 3-cyclopropyl-N-ethyl-2-propoxypropanamide (CID 89093015) is 3-cyclopropyl-N-ethyl-2-propoxypropanamide.
What is the SMILES notation for 3-cyclopropyl-N-ethyl-2-propoxypropanamide?
The canonical SMILES for 3-cyclopropyl-N-ethyl-2-propoxypropanamide is CCCOC(CC1CC1)C(=O)NCC.
What is the InChIKey of 3-cyclopropyl-N-ethyl-2-propoxypropanamide?
The InChIKey is YCQBKPOTVYCYPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-7-14-10(8-9-5-6-9)11(13)12-4-2/h9-10H,3-8H2,1-2H3,(H,12,13).
What are the key properties of 3-cyclopropyl-N-ethyl-2-propoxypropanamide?
3-cyclopropyl-N-ethyl-2-propoxypropanamide has a molecular weight of 199.29 g/mol, XLogP of 1.72, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-ethyl-2-propoxypropanamide is sourced from PubChem (CID 89093015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).