prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate

C14H21NO5 — CID 69318204

IUPACprop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate
SMILESC=CCOC(=O)NC1CC(=O)OC1(OC)C1CCCC1
InChIInChI=1S/C14H21NO5/c1-3-8-19-13(17)15-11-9-12(16)20-14(11,18-2)10-6-4-5-7-10/h3,10-11H,1,4-9H2,2H3,(H,15,17)
InChIKeyQFLOPRVODGZCML-UHFFFAOYSA-N
MW283.32 g/mol
LogP1.75
Rot. Bonds5

About prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate

prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate (PubChem CID 69318204) has the molecular formula C14H21NO5 and a molecular weight of 283.32 g/mol. Its IUPAC name is prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate.

Molecular Properties

Compound Nameprop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate
PubChem CID69318204
Molecular FormulaC14H21NO5
Molecular Weight283.32 g/mol
Exact Mass283.14
IUPAC Nameprop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate
SMILESC=CCOC(=O)NC1CC(=O)OC1(OC)C1CCCC1
InChIInChI=1S/C14H21NO5/c1-3-8-19-13(17)15-11-9-12(16)20-14(11,18-2)10-6-4-5-7-10/h3,10-11H,1,4-9H2,2H3,(H,15,17)
InChIKeyQFLOPRVODGZCML-UHFFFAOYSA-N
XLogP1.75
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate?
The IUPAC name of prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate (CID 69318204) is prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate.
What is the SMILES notation for prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate?
The canonical SMILES for prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate is C=CCOC(=O)NC1CC(=O)OC1(OC)C1CCCC1.
What is the InChIKey of prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate?
The InChIKey is QFLOPRVODGZCML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO5/c1-3-8-19-13(17)15-11-9-12(16)20-14(11,18-2)10-6-4-5-7-10/h3,10-11H,1,4-9H2,2H3,(H,15,17).
What are the key properties of prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate?
prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate has a molecular weight of 283.32 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enyl N-(2-cyclopentyl-2-methoxy-5-oxooxolan-3-yl)carbamate is sourced from PubChem (CID 69318204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).