N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide

C15H22N2O3 — CID 61366412

IUPACN-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
SMILESCOCCOc1ccc(NC(=O)CC2CCCN2)cc1
InChIInChI=1S/C15H22N2O3/c1-19-9-10-20-14-6-4-12(5-7-14)17-15(18)11-13-3-2-8-16-13/h4-7,13,16H,2-3,8-11H2,1H3,(H,17,18)
InChIKeyVMQBHONOSOWUAA-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.79
Rot. Bonds7

About N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide

N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 61366412) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
PubChem CID61366412
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
SMILESCOCCOc1ccc(NC(=O)CC2CCCN2)cc1
InChIInChI=1S/C15H22N2O3/c1-19-9-10-20-14-6-4-12(5-7-14)17-15(18)11-13-3-2-8-16-13/h4-7,13,16H,2-3,8-11H2,1H3,(H,17,18)
InChIKeyVMQBHONOSOWUAA-UHFFFAOYSA-N
XLogP1.79
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670724
N-(4-acetamidophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119669050
N-propan-2-yl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide;hydrochloride
CID 119740098
4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline
CID 106633476
methyl 2-[[4-[(2-pyrrolidin-2-ylacetyl)amino]benzoyl]amino]acetate;hydrochloride
CID 119692977
N-(4-chlorophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119671239
N-[4-(2-methoxyethoxy)phenyl]piperidine-2-carboxamide
CID 43713427
N-[4-(oxolan-3-yloxy)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119798692
N-[5-fluoro-2-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119756535
N-phenyl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 119756453
N-[4-(4-methylpyrimidin-2-yl)oxyphenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119812384
N-[3-(4-methylphenoxy)propyl]-2-pyrrolidin-2-ylacetamide
CID 119757273

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide (CID 61366412) is N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide is COCCOc1ccc(NC(=O)CC2CCCN2)cc1.
What is the InChIKey of N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is VMQBHONOSOWUAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-19-9-10-20-14-6-4-12(5-7-14)17-15(18)11-13-3-2-8-16-13/h4-7,13,16H,2-3,8-11H2,1H3,(H,17,18).
What are the key properties of N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide?
N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 278.35 g/mol, XLogP of 1.79, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 61366412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).