3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide

C19H24N2O4 — CID 122154559

IUPAC3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide
SMILESNC(=O)C(O)(CN1CCCC1CC(O)c1ccco1)c1ccccc1
InChIInChI=1S/C19H24N2O4/c20-18(23)19(24,14-6-2-1-3-7-14)13-21-10-4-8-15(21)12-16(22)17-9-5-11-25-17/h1-3,5-7,9,11,15-16,22,24H,4,8,10,12-13H2,(H2,20,23)
InChIKeyRDZFNDTVZKYFQD-UHFFFAOYSA-N
MW344.41 g/mol
LogP1.54
Rot. Bonds7

About 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide

3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide (PubChem CID 122154559) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide.

Molecular Properties

Compound Name3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide
PubChem CID122154559
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide
SMILESNC(=O)C(O)(CN1CCCC1CC(O)c1ccco1)c1ccccc1
InChIInChI=1S/C19H24N2O4/c20-18(23)19(24,14-6-2-1-3-7-14)13-21-10-4-8-15(21)12-16(22)17-9-5-11-25-17/h1-3,5-7,9,11,15-16,22,24H,4,8,10,12-13H2,(H2,20,23)
InChIKeyRDZFNDTVZKYFQD-UHFFFAOYSA-N
XLogP1.54
TPSA99.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl N-[(1S,2S)-1-(furan-2-yl)-1-hydroxy-3-phenylpropan-2-yl]carbamate
CID 16060307
3-[4-(2-Benzhydryloxy-ethyl)-piperazin-1-yl]-1-furan-2-yl-propan-1-ol
CID 44278840
(4R,5R)-5-[(R)-Hydroxy-(5-phenyl-furan-2-yl)-methyl]-1-methyl-4-phenyl-pyrrolidin-2-one
CID 44397774
(4R,5R)-5-((R)-Furan-2-yl-hydroxy-methyl)-1-methyl-4-phenyl-pyrrolidin-2-one
CID 44397884
(4R,5R)-5-[(R)-(5-Bromo-furan-2-yl)-hydroxy-methyl]-1-methyl-4-phenyl-pyrrolidin-2-one
CID 44397895
(2R,8aR)-7-(furan-2-yl)-2-hydroxy-6-phenyl-2,3,8,8a-tetrahydro-1H-indolizin-5-one
CID 72206212
(2R,8aS)-7-(furan-2-yl)-2-hydroxy-6-phenyl-2,3,8,8a-tetrahydro-1H-indolizin-5-one
CID 72206393
1-(furan-2-yl)-2-[(2R,4R)-4-hydroxy-1-(2-phenylacetyl)pyrrolidin-2-yl]ethanone
CID 72206396
1-(furan-2-yl)-2-[(4R)-4-hydroxy-1-(2-phenylacetyl)pyrrolidin-2-yl]ethanone
CID 73352134
1-(Furan-2-yl)-2-methyl-1-phenyl-3-(pyrrolidin-1-yl)propan-1-ol
CID 199420
1-(furan-2-yl)-2-[(2S,4R)-4-hydroxy-1-(2-phenylacetyl)pyrrolidin-2-yl]ethanone
CID 72206570
(1S,2S)-2-amino-1-(furan-2-yl)-3-phenylpropan-1-ol
CID 16060309

Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide?
The IUPAC name of 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide (CID 122154559) is 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide.
What is the SMILES notation for 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide?
The canonical SMILES for 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide is NC(=O)C(O)(CN1CCCC1CC(O)c1ccco1)c1ccccc1.
What is the InChIKey of 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide?
The InChIKey is RDZFNDTVZKYFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c20-18(23)19(24,14-6-2-1-3-7-14)13-21-10-4-8-15(21)12-16(22)17-9-5-11-25-17/h1-3,5-7,9,11,15-16,22,24H,4,8,10,12-13H2,(H2,20,23).
What are the key properties of 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide?
3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide has a molecular weight of 344.41 g/mol, XLogP of 1.54, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-(furan-2-yl)-2-hydroxyethyl]pyrrolidin-1-yl]-2-hydroxy-2-phenylpropanamide is sourced from PubChem (CID 122154559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).