N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide

C7H9NO3 — CID 170232983

IUPACN-methyl-6-oxo-2,3-dihydropyran-4-carboxamide
SMILESCNC(=O)C1=CC(=O)OCC1
InChIInChI=1S/C7H9NO3/c1-8-7(10)5-2-3-11-6(9)4-5/h4H,2-3H2,1H3,(H,8,10)
InChIKeyPEMGASCOAYQVAY-UHFFFAOYSA-N
MW155.15 g/mol
LogP-0.39
Rot. Bonds1

About N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide

N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide (PubChem CID 170232983) has the molecular formula C7H9NO3 and a molecular weight of 155.15 g/mol. Its IUPAC name is N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-2,3-dihydropyran-4-carboxamide
PubChem CID170232983
Molecular FormulaC7H9NO3
Molecular Weight155.15 g/mol
Exact Mass155.06
IUPAC NameN-methyl-6-oxo-2,3-dihydropyran-4-carboxamide
SMILESCNC(=O)C1=CC(=O)OCC1
InChIInChI=1S/C7H9NO3/c1-8-7(10)5-2-3-11-6(9)4-5/h4H,2-3H2,1H3,(H,8,10)
InChIKeyPEMGASCOAYQVAY-UHFFFAOYSA-N
XLogP-0.39
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.15
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide?
The IUPAC name of N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide (CID 170232983) is N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide?
The canonical SMILES for N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide is CNC(=O)C1=CC(=O)OCC1.
What is the InChIKey of N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide?
The InChIKey is PEMGASCOAYQVAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO3/c1-8-7(10)5-2-3-11-6(9)4-5/h4H,2-3H2,1H3,(H,8,10).
What are the key properties of N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide?
N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide has a molecular weight of 155.15 g/mol, XLogP of -0.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-2,3-dihydropyran-4-carboxamide is sourced from PubChem (CID 170232983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).