5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid

C11H17NO5 — CID 102687708

IUPAC5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid
SMILESO=C(O)C1CCC(C(=O)N(CCO)C2CC2)O1
InChIInChI=1S/C11H17NO5/c13-6-5-12(7-1-2-7)10(14)8-3-4-9(17-8)11(15)16/h7-9,13H,1-6H2,(H,15,16)
InChIKeyWGSIIRUYEHNWSD-UHFFFAOYSA-N
MW243.26 g/mol
LogP-0.40
Rot. Bonds5

About 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid

5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid (PubChem CID 102687708) has the molecular formula C11H17NO5 and a molecular weight of 243.26 g/mol. Its IUPAC name is 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid.

Molecular Properties

Compound Name5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid
PubChem CID102687708
Molecular FormulaC11H17NO5
Molecular Weight243.26 g/mol
Exact Mass243.11
IUPAC Name5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid
SMILESO=C(O)C1CCC(C(=O)N(CCO)C2CC2)O1
InChIInChI=1S/C11H17NO5/c13-6-5-12(7-1-2-7)10(14)8-3-4-9(17-8)11(15)16/h7-9,13H,1-6H2,(H,15,16)
InChIKeyWGSIIRUYEHNWSD-UHFFFAOYSA-N
XLogP-0.40
TPSA87.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-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

(2R,5S)-5-[cyclopropyl(cyclopropylmethyl)carbamoyl]oxolane-2-carboxylic acid
CID 102945325
(2R,5S)-5-[cyclopropyl(2,2,2-trifluoroethyl)carbamoyl]oxolane-2-carboxylic acid
CID 102945105
N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide
CID 81330576
5-[cyclopentyl(3-methylbutyl)carbamoyl]oxolane-2-carboxylic acid
CID 102688711
(2R,5S)-5-[cyclopropyl(methyl)carbamoyl]oxolane-2-carboxylic acid
CID 102944218
5-[cyclopropyl-(2-ethoxy-2-oxoethyl)carbamoyl]oxolane-2-carboxylic acid
CID 102688226
5-[2-hydroxyethyl(2-methoxyethyl)carbamoyl]oxolane-2-carboxylic acid
CID 102688956
(2R,5S)-oxolane-2,5-dicarboxylic acid
CID 12667635
(2R,5S)-5-[hexyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid
CID 102944931
5-[2-methoxyethyl(thiolan-3-yl)carbamoyl]oxolane-2-carboxylic acid
CID 102688134
5-[cyclopropyl(2-hydroxyethyl)carbamoyl]-4,5-dihydro-1,2-oxazole-3-carboxylic acid
CID 107426983
N-cyclopentyl-N-(2-hydroxyethyl)cyclohexanecarboxamide
CID 54994642

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid?
The IUPAC name of 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid (CID 102687708) is 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid.
What is the SMILES notation for 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid?
The canonical SMILES for 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid is O=C(O)C1CCC(C(=O)N(CCO)C2CC2)O1.
What is the InChIKey of 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid?
The InChIKey is WGSIIRUYEHNWSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO5/c13-6-5-12(7-1-2-7)10(14)8-3-4-9(17-8)11(15)16/h7-9,13H,1-6H2,(H,15,16).
What are the key properties of 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid?
5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid has a molecular weight of 243.26 g/mol, XLogP of -0.40, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopropyl(2-hydroxyethyl)carbamoyl]oxolane-2-carboxylic acid is sourced from PubChem (CID 102687708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).