N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide

C17H26N2O2 — CID 50982632

IUPACN-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide
SMILESCCc1ccccc1OCCN(C)C(=O)CN1CCCC1
InChIInChI=1S/C17H26N2O2/c1-3-15-8-4-5-9-16(15)21-13-12-18(2)17(20)14-19-10-6-7-11-19/h4-5,8-9H,3,6-7,10-14H2,1-2H3
InChIKeyAYXVZAOPDKFSFT-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.18
Rot. Bonds7

About N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide

N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide (PubChem CID 50982632) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide
PubChem CID50982632
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide
SMILESCCc1ccccc1OCCN(C)C(=O)CN1CCCC1
InChIInChI=1S/C17H26N2O2/c1-3-15-8-4-5-9-16(15)21-13-12-18(2)17(20)14-19-10-6-7-11-19/h4-5,8-9H,3,6-7,10-14H2,1-2H3
InChIKeyAYXVZAOPDKFSFT-UHFFFAOYSA-N
XLogP2.18
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide (CID 50982632) is N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide is CCc1ccccc1OCCN(C)C(=O)CN1CCCC1.
What is the InChIKey of N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide?
The InChIKey is AYXVZAOPDKFSFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-15-8-4-5-9-16(15)21-13-12-18(2)17(20)14-19-10-6-7-11-19/h4-5,8-9H,3,6-7,10-14H2,1-2H3.
What are the key properties of N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide?
N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.18, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethylphenoxy)ethyl]-N-methyl-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 50982632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).