N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide

C17H30N2O5 — CID 162804971

IUPACN-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide
SMILESCOCC1CCCN1CC1OCC(NC(=O)C2CCOCC2)C1O
InChIInChI=1S/C17H30N2O5/c1-22-10-13-3-2-6-19(13)9-15-16(20)14(11-24-15)18-17(21)12-4-7-23-8-5-12/h12-16,20H,2-11H2,1H3,(H,18,21)
InChIKeyJDFNXAOJMVQLGW-UHFFFAOYSA-N
MW342.44 g/mol
LogP-0.23
Rot. Bonds6

About N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide

N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide (PubChem CID 162804971) has the molecular formula C17H30N2O5 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide
PubChem CID162804971
Molecular FormulaC17H30N2O5
Molecular Weight342.44 g/mol
Exact Mass342.22
IUPAC NameN-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide
SMILESCOCC1CCCN1CC1OCC(NC(=O)C2CCOCC2)C1O
InChIInChI=1S/C17H30N2O5/c1-22-10-13-3-2-6-19(13)9-15-16(20)14(11-24-15)18-17(21)12-4-7-23-8-5-12/h12-16,20H,2-11H2,1H3,(H,18,21)
InChIKeyJDFNXAOJMVQLGW-UHFFFAOYSA-N
XLogP-0.23
TPSA80.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide?
The IUPAC name of N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide (CID 162804971) is N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide.
What is the SMILES notation for N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide?
The canonical SMILES for N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide is COCC1CCCN1CC1OCC(NC(=O)C2CCOCC2)C1O.
What is the InChIKey of N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide?
The InChIKey is JDFNXAOJMVQLGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O5/c1-22-10-13-3-2-6-19(13)9-15-16(20)14(11-24-15)18-17(21)12-4-7-23-8-5-12/h12-16,20H,2-11H2,1H3,(H,18,21).
What are the key properties of N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide?
N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide has a molecular weight of 342.44 g/mol, XLogP of -0.23, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide is sourced from PubChem (CID 162804971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).