1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one

C19H23NO2 — CID 11197267

IUPAC1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one
SMILESCCCC(C(=O)c1ccc(-c2ccco2)cc1)N1CCCC1
InChIInChI=1S/C19H23NO2/c1-2-6-17(20-12-3-4-13-20)19(21)16-10-8-15(9-11-16)18-7-5-14-22-18/h5,7-11,14,17H,2-4,6,12-13H2,1H3
InChIKeyULUHBYVKNOUSDX-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.39
Rot. Bonds6

About 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one

1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one (PubChem CID 11197267) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one.

Molecular Properties

Compound Name1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one
PubChem CID11197267
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one
SMILESCCCC(C(=O)c1ccc(-c2ccco2)cc1)N1CCCC1
InChIInChI=1S/C19H23NO2/c1-2-6-17(20-12-3-4-13-20)19(21)16-10-8-15(9-11-16)18-7-5-14-22-18/h5,7-11,14,17H,2-4,6,12-13H2,1H3
InChIKeyULUHBYVKNOUSDX-UHFFFAOYSA-N
XLogP4.39
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(Pyrrolidin-1-yl)-1-(4-methoxyphenyl)pentan-1-one
CID 11299968
4'-Methoxy-alpha-pyrrolidinopropiophenone
CID 6430836
4-Methoxy-alpha-phpp
CID 102144586
(2S)-1-[(2S)-2-amino-3-[4-(furan-2-yl)phenyl]propanoyl]pyrrolidine-2-carbonitrile
CID 23645378
(E)-3-[5-(4-fluorophenyl)furan-2-yl]-1-pyrrolidin-1-ylprop-2-en-1-one
CID 2324886
N-(furan-2-ylmethyl)-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide
CID 2929761
1-[2-(4-Furan-2-ylmethyl-phenoxy)-ethyl]-pyrrolidine
CID 10588193
1-[2-(4-Furan-3-ylmethyl-phenoxy)-ethyl]-pyrrolidine
CID 10825997
2-(3,3-difluoropyrrolidin-1-yl)-1-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]ethanone
CID 49858393
(2S)-5-(furan-2-yl)-N,N-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 156022244
Moppp, (S)-
CID 66833826
Methyl 3-(4-(furan-2-yl)phenyl)-8-methyl-8-aza-bicyclo[3.2.1]octane-2-carboxylate
CID 10131344

Frequently Asked Questions

What is the IUPAC name of 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one?
The IUPAC name of 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one (CID 11197267) is 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one.
What is the SMILES notation for 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one?
The canonical SMILES for 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one is CCCC(C(=O)c1ccc(-c2ccco2)cc1)N1CCCC1.
What is the InChIKey of 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one?
The InChIKey is ULUHBYVKNOUSDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-2-6-17(20-12-3-4-13-20)19(21)16-10-8-15(9-11-16)18-7-5-14-22-18/h5,7-11,14,17H,2-4,6,12-13H2,1H3.
What are the key properties of 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one?
1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one has a molecular weight of 297.40 g/mol, XLogP of 4.39, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(furan-2-yl)phenyl]-2-pyrrolidin-1-ylpentan-1-one is sourced from PubChem (CID 11197267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).