ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate

C10H20N2O2 — CID 63300317

IUPACethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate
SMILESCCOC(=O)CN(CC)C1CCNC1
InChIInChI=1S/C10H20N2O2/c1-3-12(8-10(13)14-4-2)9-5-6-11-7-9/h9,11H,3-8H2,1-2H3
InChIKeyRJLSLTQIZCICGR-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.23
Rot. Bonds5

About ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate

ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate (PubChem CID 63300317) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate
PubChem CID63300317
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nameethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate
SMILESCCOC(=O)CN(CC)C1CCNC1
InChIInChI=1S/C10H20N2O2/c1-3-12(8-10(13)14-4-2)9-5-6-11-7-9/h9,11H,3-8H2,1-2H3
InChIKeyRJLSLTQIZCICGR-UHFFFAOYSA-N
XLogP0.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate?
The IUPAC name of ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate (CID 63300317) is ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate.
What is the SMILES notation for ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate?
The canonical SMILES for ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate is CCOC(=O)CN(CC)C1CCNC1.
What is the InChIKey of ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate?
The InChIKey is RJLSLTQIZCICGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-12(8-10(13)14-4-2)9-5-6-11-7-9/h9,11H,3-8H2,1-2H3.
What are the key properties of ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate?
ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate has a molecular weight of 200.28 g/mol, XLogP of 0.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[ethyl(pyrrolidin-3-yl)amino]acetate is sourced from PubChem (CID 63300317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).