5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide

C10H11NO4 — CID 135077053

IUPAC5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide
SMILESC=CCN(C)C(=O)c1cc(=O)c(O)co1
InChIInChI=1S/C10H11NO4/c1-3-4-11(2)10(14)9-5-7(12)8(13)6-15-9/h3,5-6,13H,1,4H2,2H3
InChIKeyOCRONPIANHQMGH-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.60
Rot. Bonds3

About 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide

5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide (PubChem CID 135077053) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide
PubChem CID135077053
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide
SMILESC=CCN(C)C(=O)c1cc(=O)c(O)co1
InChIInChI=1S/C10H11NO4/c1-3-4-11(2)10(14)9-5-7(12)8(13)6-15-9/h3,5-6,13H,1,4H2,2H3
InChIKeyOCRONPIANHQMGH-UHFFFAOYSA-N
XLogP0.60
TPSA70.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[(5-hydroxy-4-oxopyran-2-yl)methyl]acetamide
CID 90672508
2-[(Dimethylamino)methyl]-5-hydroxypyran-4-one
CID 90672509
N-ethyl-3-hydroxy-4-oxo-4H-pyran-2-carboxamide
CID 54748756
2-[(Dimethylamino)methyl]-3-hydroxypyran-4-one
CID 57054355
2-[[Ethyl(propyl)amino]methyl]-3-hydroxypyran-4-one
CID 91395945
N,N-bis(2-hydroxyethyl)-2,3-dihydrofuran-5-carboxamide
CID 123589572
3-hydroxy-4-oxo-N-propylpyran-2-carboxamide
CID 143761978
ZINC;2-ethyl-3-hydroxypyran-4-one;1-ethyl-3-hydroxypyridin-2-one
CID 158770174
N-allyl-5-methoxy-4-oxo-4H-pyran-2-carboxamide
CID 45537838
5-Hydroxy-2-[[2-hydroxyethyl(methyl)amino]methyl]pyran-4-one
CID 60683914
2-[[Ethyl(2-hydroxyethyl)amino]methyl]-5-hydroxypyran-4-one
CID 60685805
2-[[Bis(2-hydroxyethyl)amino]methyl]-5-hydroxypyran-4-one
CID 60686429

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide?
The IUPAC name of 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide (CID 135077053) is 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide.
What is the SMILES notation for 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide?
The canonical SMILES for 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide is C=CCN(C)C(=O)c1cc(=O)c(O)co1.
What is the InChIKey of 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide?
The InChIKey is OCRONPIANHQMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-3-4-11(2)10(14)9-5-7(12)8(13)6-15-9/h3,5-6,13H,1,4H2,2H3.
What are the key properties of 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide?
5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide has a molecular weight of 209.20 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-methyl-4-oxo-N-prop-2-enylpyran-2-carboxamide is sourced from PubChem (CID 135077053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).