N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide

C20H30N2O — CID 56510051

IUPACN-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide
SMILESO=C(NCCCC1CCCC1)C(c1ccccc1)N1CCCC1
InChIInChI=1S/C20H30N2O/c23-20(21-14-8-11-17-9-4-5-10-17)19(22-15-6-7-16-22)18-12-2-1-3-13-18/h1-3,12-13,17,19H,4-11,14-16H2,(H,21,23)
InChIKeyRGLKXARZPMWLOI-UHFFFAOYSA-N
MW314.47 g/mol
LogP3.91
Rot. Bonds7

About N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide

N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide (PubChem CID 56510051) has the molecular formula C20H30N2O and a molecular weight of 314.47 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide
PubChem CID56510051
Molecular FormulaC20H30N2O
Molecular Weight314.47 g/mol
Exact Mass314.24
IUPAC NameN-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide
SMILESO=C(NCCCC1CCCC1)C(c1ccccc1)N1CCCC1
InChIInChI=1S/C20H30N2O/c23-20(21-14-8-11-17-9-4-5-10-17)19(22-15-6-7-16-22)18-12-2-1-3-13-18/h1-3,12-13,17,19H,4-11,14-16H2,(H,21,23)
InChIKeyRGLKXARZPMWLOI-UHFFFAOYSA-N
XLogP3.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.47
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-cyclopentylpropyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56577591
(2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 94749994
N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-2-(4-cyclohexylpiperazin-1-yl)-2-phenylacetamide;molecular hydrogen
CID 161237581
(2S)-N-methyl-2-phenyl-2-piperidin-1-ylacetamide
CID 67962694
(2R)-N-butyl-2-(1,1-dioxo-1,4-thiazinan-4-yl)-2-phenylacetamide
CID 94825159
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-[4-(2-cyclohexylethyl)piperazin-1-yl]-2-phenylacetamide
CID 22086513
(2S)-2-phenyl-2-pyrrolidin-1-yl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide
CID 52523009
(2R)-N-(ethylcarbamoyl)-2-phenyl-2-piperidin-1-ylacetamide
CID 26551632
(2R)-2-(4-methylpiperazin-1-yl)-2-phenyl-N-propylacetamide
CID 94820416
2-amino-N-(2-cyclopentylethyl)-2-phenylacetamide;hydrochloride
CID 119289820
2-(3-aminophenyl)-N-(3-cyclopentylpropyl)propanamide
CID 106006314
2-phenyl-2-pyrrolidin-1-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide
CID 56509917

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide (CID 56510051) is N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide is O=C(NCCCC1CCCC1)C(c1ccccc1)N1CCCC1.
What is the InChIKey of N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide?
The InChIKey is RGLKXARZPMWLOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O/c23-20(21-14-8-11-17-9-4-5-10-17)19(22-15-6-7-16-22)18-12-2-1-3-13-18/h1-3,12-13,17,19H,4-11,14-16H2,(H,21,23).
What are the key properties of N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide?
N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide has a molecular weight of 314.47 g/mol, XLogP of 3.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 56510051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).