N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide

C14H19FN2O — CID 61371571

IUPACN-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)NCCc1ccc(F)cc1
InChIInChI=1S/C14H19FN2O/c15-12-5-3-11(4-6-12)7-9-17-14(18)10-13-2-1-8-16-13/h3-6,13,16H,1-2,7-10H2,(H,17,18)
InChIKeyAQSNGWLTSLSNRU-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.63
Rot. Bonds5

About N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide

N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 61371571) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide
PubChem CID61371571
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)NCCc1ccc(F)cc1
InChIInChI=1S/C14H19FN2O/c15-12-5-3-11(4-6-12)7-9-17-14(18)10-13-2-1-8-16-13/h3-6,13,16H,1-2,7-10H2,(H,17,18)
InChIKeyAQSNGWLTSLSNRU-UHFFFAOYSA-N
XLogP1.63
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 61371395
N-[2-(2-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 61371407
2-(4-fluorophenyl)-N-(2-piperidin-2-ylethyl)acetamide
CID 24704522
N-[4-(4-nitrophenyl)butyl]-2-pyrrolidin-2-ylacetamide
CID 119778328
1-(4-fluorophenyl)-3-pyrrolidin-2-ylpropan-2-one
CID 116560826
(2S)-N-[2-(4-fluorophenyl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119263955
3-[2-[(2-pyrrolidin-2-ylacetyl)amino]ethyl]benzamide;hydrochloride
CID 119770329
N-[3-(2-phenylethoxy)propyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119739702
N-[(4-chlorophenyl)methyl]-2-pyrrolidin-2-ylacetamide
CID 61372532
2-(4-fluorophenyl)-N-(piperidin-2-ylmethyl)ethanamine
CID 106632818
2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide
CID 115160524
N-[[3-fluoro-4-(hydroxymethyl)phenyl]methyl]-2-pyrrolidin-2-ylacetamide
CID 119744906

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide (CID 61371571) is N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide is O=C(CC1CCCN1)NCCc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is AQSNGWLTSLSNRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c15-12-5-3-11(4-6-12)7-9-17-14(18)10-13-2-1-8-16-13/h3-6,13,16H,1-2,7-10H2,(H,17,18).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide?
N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 250.32 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 61371571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).