5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide

C13H15NO4 — CID 110888986

IUPAC5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide
SMILESCCc1ccc(C(=O)NCC(O)c2ccco2)o1
InChIInChI=1S/C13H15NO4/c1-2-9-5-6-12(18-9)13(16)14-8-10(15)11-4-3-7-17-11/h3-7,10,15H,2,8H2,1H3,(H,14,16)
InChIKeyCUXBUGVLYSMDCM-UHFFFAOYSA-N
MW249.27 g/mol
LogP1.90
Rot. Bonds5

About 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide

5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide (PubChem CID 110888986) has the molecular formula C13H15NO4 and a molecular weight of 249.27 g/mol. Its IUPAC name is 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide
PubChem CID110888986
Molecular FormulaC13H15NO4
Molecular Weight249.27 g/mol
Exact Mass249.10
IUPAC Name5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide
SMILESCCc1ccc(C(=O)NCC(O)c2ccco2)o1
InChIInChI=1S/C13H15NO4/c1-2-9-5-6-12(18-9)13(16)14-8-10(15)11-4-3-7-17-11/h3-7,10,15H,2,8H2,1H3,(H,14,16)
InChIKeyCUXBUGVLYSMDCM-UHFFFAOYSA-N
XLogP1.90
TPSA75.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide
CID 65034203
N-[2-(5-chlorothiophen-2-yl)-2-hydroxyethyl]-5-ethylfuran-2-carboxamide
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N-[(3S)-3-(furan-2-yl)-3-hydroxypropyl]-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 95740980
N-[2-(furan-2-yl)-2-hydroxyethyl]-5-methylthiophene-2-carboxamide
CID 110889308
4-[ethyl(methyl)amino]-N-[2-(furan-2-yl)-2-hydroxyethyl]benzamide
CID 110908170
5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide
CID 107299752
N-ethyl-N'-[2-(furan-2-yl)-2-hydroxyethyl]pentanediamide
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CID 111788924

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide (CID 110888986) is 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide is CCc1ccc(C(=O)NCC(O)c2ccco2)o1.
What is the InChIKey of 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide?
The InChIKey is CUXBUGVLYSMDCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO4/c1-2-9-5-6-12(18-9)13(16)14-8-10(15)11-4-3-7-17-11/h3-7,10,15H,2,8H2,1H3,(H,14,16).
What are the key properties of 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide?
5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide has a molecular weight of 249.27 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide is sourced from PubChem (CID 110888986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).