2-propoxy-N-propylpropanamide

C9H19NO2 — CID 87338730

IUPAC2-propoxy-N-propylpropanamide
SMILESCCCNC(=O)C(C)OCCC
InChIInChI=1S/C9H19NO2/c1-4-6-10-9(11)8(3)12-7-5-2/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyGUJRNVWYHXKJLO-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.33
Rot. Bonds6

About 2-propoxy-N-propylpropanamide

2-propoxy-N-propylpropanamide (PubChem CID 87338730) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-propoxy-N-propylpropanamide.

Molecular Properties

Compound Name2-propoxy-N-propylpropanamide
PubChem CID87338730
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-propoxy-N-propylpropanamide
SMILESCCCNC(=O)C(C)OCCC
InChIInChI=1S/C9H19NO2/c1-4-6-10-9(11)8(3)12-7-5-2/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyGUJRNVWYHXKJLO-UHFFFAOYSA-N
XLogP1.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propoxy-N-propylpropanamide?
The IUPAC name of 2-propoxy-N-propylpropanamide (CID 87338730) is 2-propoxy-N-propylpropanamide.
What is the SMILES notation for 2-propoxy-N-propylpropanamide?
The canonical SMILES for 2-propoxy-N-propylpropanamide is CCCNC(=O)C(C)OCCC.
What is the InChIKey of 2-propoxy-N-propylpropanamide?
The InChIKey is GUJRNVWYHXKJLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-4-6-10-9(11)8(3)12-7-5-2/h8H,4-7H2,1-3H3,(H,10,11).
What are the key properties of 2-propoxy-N-propylpropanamide?
2-propoxy-N-propylpropanamide has a molecular weight of 173.26 g/mol, XLogP of 1.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propoxy-N-propylpropanamide is sourced from PubChem (CID 87338730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).