5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide

C11H15NO3 — CID 115764668

IUPAC5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide
SMILESCCc1ccc(C(=O)NC2(CO)CC2)o1
InChIInChI=1S/C11H15NO3/c1-2-8-3-4-9(15-8)10(14)12-11(7-13)5-6-11/h3-4,13H,2,5-7H2,1H3,(H,12,14)
InChIKeyULVJUKQMYLFWMJ-UHFFFAOYSA-N
MW209.24 g/mol
LogP1.10
Rot. Bonds4

About 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide

5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide (PubChem CID 115764668) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide
PubChem CID115764668
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide
SMILESCCc1ccc(C(=O)NC2(CO)CC2)o1
InChIInChI=1S/C11H15NO3/c1-2-8-3-4-9(15-8)10(14)12-11(7-13)5-6-11/h3-4,13H,2,5-7H2,1H3,(H,12,14)
InChIKeyULVJUKQMYLFWMJ-UHFFFAOYSA-N
XLogP1.10
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide (CID 115764668) is 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide is CCc1ccc(C(=O)NC2(CO)CC2)o1.
What is the InChIKey of 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide?
The InChIKey is ULVJUKQMYLFWMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-2-8-3-4-9(15-8)10(14)12-11(7-13)5-6-11/h3-4,13H,2,5-7H2,1H3,(H,12,14).
What are the key properties of 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide?
5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide has a molecular weight of 209.24 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide is sourced from PubChem (CID 115764668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).