N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide

C14H20N2O4 — CID 71977245

IUPACN-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide
SMILESCCC1COCCN1C(=O)CNC(=O)c1ccoc1C
InChIInChI=1S/C14H20N2O4/c1-3-11-9-19-7-5-16(11)13(17)8-15-14(18)12-4-6-20-10(12)2/h4,6,11H,3,5,7-9H2,1-2H3,(H,15,18)
InChIKeyVTHZVFKXAKYJSO-UHFFFAOYSA-N
MW280.32 g/mol
LogP0.96
Rot. Bonds4

About N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide

N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide (PubChem CID 71977245) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide
PubChem CID71977245
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC NameN-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide
SMILESCCC1COCCN1C(=O)CNC(=O)c1ccoc1C
InChIInChI=1S/C14H20N2O4/c1-3-11-9-19-7-5-16(11)13(17)8-15-14(18)12-4-6-20-10(12)2/h4,6,11H,3,5,7-9H2,1-2H3,(H,15,18)
InChIKeyVTHZVFKXAKYJSO-UHFFFAOYSA-N
XLogP0.96
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide?
The IUPAC name of N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide (CID 71977245) is N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide?
The canonical SMILES for N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide is CCC1COCCN1C(=O)CNC(=O)c1ccoc1C.
What is the InChIKey of N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide?
The InChIKey is VTHZVFKXAKYJSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-3-11-9-19-7-5-16(11)13(17)8-15-14(18)12-4-6-20-10(12)2/h4,6,11H,3,5,7-9H2,1-2H3,(H,15,18).
What are the key properties of N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide?
N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide has a molecular weight of 280.32 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-ethylmorpholin-4-yl)-2-oxoethyl]-2-methylfuran-3-carboxamide is sourced from PubChem (CID 71977245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).