N-hydroxy-2-methyloxolane-3-carboxamide

C6H11NO3 — CID 79759283

IUPACN-hydroxy-2-methyloxolane-3-carboxamide
SMILESCC1OCCC1C(=O)NO
InChIInChI=1S/C6H11NO3/c1-4-5(2-3-10-4)6(8)7-9/h4-5,9H,2-3H2,1H3,(H,7,8)
InChIKeyKDXDJLKNBGUJBO-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.08
Rot. Bonds1

About N-hydroxy-2-methyloxolane-3-carboxamide

N-hydroxy-2-methyloxolane-3-carboxamide (PubChem CID 79759283) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is N-hydroxy-2-methyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-hydroxy-2-methyloxolane-3-carboxamide
PubChem CID79759283
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC NameN-hydroxy-2-methyloxolane-3-carboxamide
SMILESCC1OCCC1C(=O)NO
InChIInChI=1S/C6H11NO3/c1-4-5(2-3-10-4)6(8)7-9/h4-5,9H,2-3H2,1H3,(H,7,8)
InChIKeyKDXDJLKNBGUJBO-UHFFFAOYSA-N
XLogP-0.08
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxy-2-methyloxolane-3-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-hydroxy-2-methyloxolane-3-carboxamide?
The IUPAC name of N-hydroxy-2-methyloxolane-3-carboxamide (CID 79759283) is N-hydroxy-2-methyloxolane-3-carboxamide.
What is the SMILES notation for N-hydroxy-2-methyloxolane-3-carboxamide?
The canonical SMILES for N-hydroxy-2-methyloxolane-3-carboxamide is CC1OCCC1C(=O)NO.
What is the InChIKey of N-hydroxy-2-methyloxolane-3-carboxamide?
The InChIKey is KDXDJLKNBGUJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-4-5(2-3-10-4)6(8)7-9/h4-5,9H,2-3H2,1H3,(H,7,8).
What are the key properties of N-hydroxy-2-methyloxolane-3-carboxamide?
N-hydroxy-2-methyloxolane-3-carboxamide has a molecular weight of 145.16 g/mol, XLogP of -0.08, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-methyloxolane-3-carboxamide is sourced from PubChem (CID 79759283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).