N-hydroxy-N-methyl-2H-chromene-3-carboxamide

C11H11NO3 — CID 14971254

IUPACN-hydroxy-N-methyl-2H-chromene-3-carboxamide
SMILESCN(O)C(=O)C1=Cc2ccccc2OC1
InChIInChI=1S/C11H11NO3/c1-12(14)11(13)9-6-8-4-2-3-5-10(8)15-7-9/h2-6,14H,7H2,1H3
InChIKeyPSYOHPSVDYJWGC-UHFFFAOYSA-N
MW205.21 g/mol
LogP1.31
Rot. Bonds1

About N-hydroxy-N-methyl-2H-chromene-3-carboxamide

N-hydroxy-N-methyl-2H-chromene-3-carboxamide (PubChem CID 14971254) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is N-hydroxy-N-methyl-2H-chromene-3-carboxamide.

Molecular Properties

Compound NameN-hydroxy-N-methyl-2H-chromene-3-carboxamide
PubChem CID14971254
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC NameN-hydroxy-N-methyl-2H-chromene-3-carboxamide
SMILESCN(O)C(=O)C1=Cc2ccccc2OC1
InChIInChI=1S/C11H11NO3/c1-12(14)11(13)9-6-8-4-2-3-5-10(8)15-7-9/h2-6,14H,7H2,1H3
InChIKeyPSYOHPSVDYJWGC-UHFFFAOYSA-N
XLogP1.31
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 51.31
H-Bond Donors ≤ 51
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-N-methyl-2H-chromene-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-N-methyl-2H-chromene-3-carboxamide?
The IUPAC name of N-hydroxy-N-methyl-2H-chromene-3-carboxamide (CID 14971254) is N-hydroxy-N-methyl-2H-chromene-3-carboxamide.
What is the SMILES notation for N-hydroxy-N-methyl-2H-chromene-3-carboxamide?
The canonical SMILES for N-hydroxy-N-methyl-2H-chromene-3-carboxamide is CN(O)C(=O)C1=Cc2ccccc2OC1.
What is the InChIKey of N-hydroxy-N-methyl-2H-chromene-3-carboxamide?
The InChIKey is PSYOHPSVDYJWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c1-12(14)11(13)9-6-8-4-2-3-5-10(8)15-7-9/h2-6,14H,7H2,1H3.
What are the key properties of N-hydroxy-N-methyl-2H-chromene-3-carboxamide?
N-hydroxy-N-methyl-2H-chromene-3-carboxamide has a molecular weight of 205.21 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-methyl-2H-chromene-3-carboxamide is sourced from PubChem (CID 14971254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).