5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid

C17H17NO5 — CID 120701801

IUPAC5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid
SMILESO=C(O)c1coc(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c1
InChIInChI=1S/C17H17NO5/c19-16(14-8-13(10-23-14)17(20)21)18-9-12-6-7-22-15(12)11-4-2-1-3-5-11/h1-5,8,10,12,15H,6-7,9H2,(H,18,19)(H,20,21)/t12-,15-/m0/s1
InChIKeyGOJYMTFQNQXLIC-WFASDCNBSA-N
MW315.33 g/mol
LogP2.49
Rot. Bonds5

About 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid

5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid (PubChem CID 120701801) has the molecular formula C17H17NO5 and a molecular weight of 315.33 g/mol. Its IUPAC name is 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid.

Molecular Properties

Compound Name5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid
PubChem CID120701801
Molecular FormulaC17H17NO5
Molecular Weight315.33 g/mol
Exact Mass315.11
IUPAC Name5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid
SMILESO=C(O)c1coc(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c1
InChIInChI=1S/C17H17NO5/c19-16(14-8-13(10-23-14)17(20)21)18-9-12-6-7-22-15(12)11-4-2-1-3-5-11/h1-5,8,10,12,15H,6-7,9H2,(H,18,19)(H,20,21)/t12-,15-/m0/s1
InChIKeyGOJYMTFQNQXLIC-WFASDCNBSA-N
XLogP2.49
TPSA88.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[(2S,3R)-2-phenyloxolan-3-yl]methylcarbamoyl]pyridine-2-carboxylic acid
CID 120701781
6-[[(2S,3R)-2-phenyloxolan-3-yl]methylcarbamoyl]pyridine-2-carboxylic acid
CID 120701779
3-amino-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]pyrazine-2-carboxamide
CID 129003341
5-[(2-methylcyclopentyl)methylcarbamoyl]furan-3-carboxylic acid
CID 107420211
cis-(1S,2R)-2-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 129402634
4-chloro-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]-1H-pyrrole-2-carboxamide
CID 129000910
3-fluoro-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]pyridine-4-carboxamide
CID 129002144
1-[[(1R,2R)-2-methylcyclopropyl]methyl]-3-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]urea
CID 129336295
5-[(4-methylmorpholin-2-yl)methylcarbamoyl]furan-3-carboxylic acid
CID 113432368
5-methyl-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]pyrazine-2-carboxamide
CID 129000874
4-methyl-6-oxo-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]-1H-pyridine-3-carboxamide
CID 129002182
N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]-2-pyrrol-1-ylpropanamide
CID 129004071

Frequently Asked Questions

What is the IUPAC name of 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid?
The IUPAC name of 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid (CID 120701801) is 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid.
What is the SMILES notation for 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid?
The canonical SMILES for 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid is O=C(O)c1coc(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c1.
What is the InChIKey of 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid?
The InChIKey is GOJYMTFQNQXLIC-WFASDCNBSA-N. The full InChI is InChI=1S/C17H17NO5/c19-16(14-8-13(10-23-14)17(20)21)18-9-12-6-7-22-15(12)11-4-2-1-3-5-11/h1-5,8,10,12,15H,6-7,9H2,(H,18,19)(H,20,21)/t12-,15-/m0/s1.
What are the key properties of 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid?
5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid has a molecular weight of 315.33 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]furan-3-carboxylic acid is sourced from PubChem (CID 120701801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).