3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide

C18H21NO3 — CID 129000871

IUPAC3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide
SMILESO=C(CCc1ccco1)NC[C@H]1CCO[C@@H]1c1ccccc1
InChIInChI=1S/C18H21NO3/c20-17(9-8-16-7-4-11-21-16)19-13-15-10-12-22-18(15)14-5-2-1-3-6-14/h1-7,11,15,18H,8-10,12-13H2,(H,19,20)/t15-,18-/m1/s1
InChIKeyQRPZGCDENVCFCU-CRAIPNDOSA-N
MW299.37 g/mol
LogP3.11
Rot. Bonds6

About 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide

3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide (PubChem CID 129000871) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide
PubChem CID129000871
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide
SMILESO=C(CCc1ccco1)NC[C@H]1CCO[C@@H]1c1ccccc1
InChIInChI=1S/C18H21NO3/c20-17(9-8-16-7-4-11-21-16)19-13-15-10-12-22-18(15)14-5-2-1-3-6-14/h1-7,11,15,18H,8-10,12-13H2,(H,19,20)/t15-,18-/m1/s1
InChIKeyQRPZGCDENVCFCU-CRAIPNDOSA-N
XLogP3.11
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(furan-2-yl)-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 64928523
2-(1,2-oxazol-3-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]acetamide
CID 129002650
cis-(1S,2R)-2-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 129402634
(2S)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]-2-pyrrol-1-ylpropanamide
CID 129328039
6-[[(2S,3R)-2-phenyloxolan-3-yl]methylcarbamoyl]pyridine-2-carboxylic acid
CID 120701779
N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]-2-pyrrol-1-ylpropanamide
CID 129004071
N-[[(3aS,6aS)-2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-yl]methyl]-3-(furan-2-yl)propanamide
CID 164632647
5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid
CID 120701801
N-ethyl-3-(furan-2-yl)propanamide
CID 60690706
N-(3-cyclopentyl-3-oxopropyl)-3-(furan-2-yl)propanamide
CID 58762649
1-[(2R)-3-methylbutan-2-yl]-3-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]urea
CID 129331695
3-(furan-2-yl)-N-[[3-[[3-(furan-2-yl)propanoylamino]methyl]phenyl]methyl]propanamide
CID 86064144

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide?
The IUPAC name of 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide (CID 129000871) is 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide is O=C(CCc1ccco1)NC[C@H]1CCO[C@@H]1c1ccccc1.
What is the InChIKey of 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide?
The InChIKey is QRPZGCDENVCFCU-CRAIPNDOSA-N. The full InChI is InChI=1S/C18H21NO3/c20-17(9-8-16-7-4-11-21-16)19-13-15-10-12-22-18(15)14-5-2-1-3-6-14/h1-7,11,15,18H,8-10,12-13H2,(H,19,20)/t15-,18-/m1/s1.
What are the key properties of 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide?
3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide has a molecular weight of 299.37 g/mol, XLogP of 3.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]propanamide is sourced from PubChem (CID 129000871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).