N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide

C13H23NO3 — CID 81330576

IUPACN-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide
SMILESCC1CCC(C(=O)N(CCO)C2CCCC2)O1
InChIInChI=1S/C13H23NO3/c1-10-6-7-12(17-10)13(16)14(8-9-15)11-4-2-3-5-11/h10-12,15H,2-9H2,1H3
InChIKeyOAVIUYBRXSEQIZ-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.32
Rot. Bonds4

About N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide

N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide (PubChem CID 81330576) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide
PubChem CID81330576
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC NameN-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide
SMILESCC1CCC(C(=O)N(CCO)C2CCCC2)O1
InChIInChI=1S/C13H23NO3/c1-10-6-7-12(17-10)13(16)14(8-9-15)11-4-2-3-5-11/h10-12,15H,2-9H2,1H3
InChIKeyOAVIUYBRXSEQIZ-UHFFFAOYSA-N
XLogP1.32
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide?
The IUPAC name of N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide (CID 81330576) is N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide?
The canonical SMILES for N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide is CC1CCC(C(=O)N(CCO)C2CCCC2)O1.
What is the InChIKey of N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide?
The InChIKey is OAVIUYBRXSEQIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c1-10-6-7-12(17-10)13(16)14(8-9-15)11-4-2-3-5-11/h10-12,15H,2-9H2,1H3.
What are the key properties of N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide?
N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide has a molecular weight of 241.33 g/mol, XLogP of 1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-(2-hydroxyethyl)-5-methyloxolane-2-carboxamide is sourced from PubChem (CID 81330576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).