N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide

C10H11NO4 — CID 27378251

IUPACN-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide
SMILESCOc1coc(C(=O)NC2CC2)cc1=O
InChIInChI=1S/C10H11NO4/c1-14-9-5-15-8(4-7(9)12)10(13)11-6-2-3-6/h4-6H,2-3H2,1H3,(H,11,13)
InChIKeyHYONSTGVGMDGHH-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.54
Rot. Bonds3

About N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide

N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide (PubChem CID 27378251) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide
PubChem CID27378251
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC NameN-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide
SMILESCOc1coc(C(=O)NC2CC2)cc1=O
InChIInChI=1S/C10H11NO4/c1-14-9-5-15-8(4-7(9)12)10(13)11-6-2-3-6/h4-6H,2-3H2,1H3,(H,11,13)
InChIKeyHYONSTGVGMDGHH-UHFFFAOYSA-N
XLogP0.54
TPSA68.54 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 ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide?
The IUPAC name of N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide (CID 27378251) is N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide?
The canonical SMILES for N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide is COc1coc(C(=O)NC2CC2)cc1=O.
What is the InChIKey of N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide?
The InChIKey is HYONSTGVGMDGHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-14-9-5-15-8(4-7(9)12)10(13)11-6-2-3-6/h4-6H,2-3H2,1H3,(H,11,13).
What are the key properties of N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide?
N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide has a molecular weight of 209.20 g/mol, XLogP of 0.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-methoxy-4-oxopyran-2-carboxamide is sourced from PubChem (CID 27378251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).