2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide

C24H26N2O2 — CID 16889464

IUPAC2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1)NCCc1ccc(N2CCCC2)cc1
InChIInChI=1S/C24H26N2O2/c27-24(18-28-23-12-9-20-5-1-2-6-21(20)17-23)25-14-13-19-7-10-22(11-8-19)26-15-3-4-16-26/h1-2,5-12,17H,3-4,13-16,18H2,(H,25,27)
InChIKeyIAHUUXWXPYRGIU-UHFFFAOYSA-N
MW374.48 g/mol
LogP4.18
Rot. Bonds7

About 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide

2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide (PubChem CID 16889464) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide
PubChem CID16889464
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC Name2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1)NCCc1ccc(N2CCCC2)cc1
InChIInChI=1S/C24H26N2O2/c27-24(18-28-23-12-9-20-5-1-2-6-21(20)17-23)25-14-13-19-7-10-22(11-8-19)26-15-3-4-16-26/h1-2,5-12,17H,3-4,13-16,18H2,(H,25,27)
InChIKeyIAHUUXWXPYRGIU-UHFFFAOYSA-N
XLogP4.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

2-naphthalen-2-yloxy-N-(4-piperidin-1-ylphenyl)acetamide
CID 7922496
2-naphthalen-2-yloxy-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]acetamide
CID 42175258
N-[2-(cyclohexen-1-yl)ethyl]-2-naphthalen-2-yloxyacetamide
CID 703716
N-[3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-2-naphthalen-2-yloxyacetamide
CID 42175402
(2S)-2-naphthalen-2-yloxy-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide
CID 99951850
N-(2-acetamidoethyl)-2-naphthalen-2-yloxyacetamide
CID 7942082
2-naphthalen-2-yloxy-N-(2-piperidin-1-ylphenyl)acetamide
CID 2006723
N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide
CID 111429697
2-(4-fluorophenoxy)-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide
CID 50945079
2-(2-fluorophenoxy)-N-[3-(4-piperidin-1-ylphenyl)propyl]acetamide
CID 16890198
N-(3,5-difluoro-4-pyrrolidin-1-ylphenyl)-2-naphthalen-2-yloxyacetamide
CID 51121498
3-methyl-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]butanamide
CID 110404917

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide (CID 16889464) is 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide is O=C(COc1ccc2ccccc2c1)NCCc1ccc(N2CCCC2)cc1.
What is the InChIKey of 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide?
The InChIKey is IAHUUXWXPYRGIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O2/c27-24(18-28-23-12-9-20-5-1-2-6-21(20)17-23)25-14-13-19-7-10-22(11-8-19)26-15-3-4-16-26/h1-2,5-12,17H,3-4,13-16,18H2,(H,25,27).
What are the key properties of 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide?
2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide has a molecular weight of 374.48 g/mol, XLogP of 4.18, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide is sourced from PubChem (CID 16889464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).