propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate

C14H25NO3 — CID 91692218

IUPACpropyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate
SMILESCCCOC(=O)CN(C)C(=O)CCC1CCCC1
InChIInChI=1S/C14H25NO3/c1-3-10-18-14(17)11-15(2)13(16)9-8-12-6-4-5-7-12/h12H,3-11H2,1-2H3
InChIKeyRUGYEEJMTIEGEJ-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.37
Rot. Bonds7

About propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate

propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate (PubChem CID 91692218) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate.

Molecular Properties

Compound Namepropyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate
PubChem CID91692218
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Namepropyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate
SMILESCCCOC(=O)CN(C)C(=O)CCC1CCCC1
InChIInChI=1S/C14H25NO3/c1-3-10-18-14(17)11-15(2)13(16)9-8-12-6-4-5-7-12/h12H,3-11H2,1-2H3
InChIKeyRUGYEEJMTIEGEJ-UHFFFAOYSA-N
XLogP2.37
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate?
The IUPAC name of propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate (CID 91692218) is propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate.
What is the SMILES notation for propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate?
The canonical SMILES for propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate is CCCOC(=O)CN(C)C(=O)CCC1CCCC1.
What is the InChIKey of propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate?
The InChIKey is RUGYEEJMTIEGEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-3-10-18-14(17)11-15(2)13(16)9-8-12-6-4-5-7-12/h12H,3-11H2,1-2H3.
What are the key properties of propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate?
propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate has a molecular weight of 255.36 g/mol, XLogP of 2.37, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propyl 2-[3-cyclopentylpropanoyl(methyl)amino]acetate is sourced from PubChem (CID 91692218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).