5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide

C9H11ClN2O3 — CID 103606891

IUPAC5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide
SMILESCCNC(=O)CNC(=O)c1ccc(Cl)o1
InChIInChI=1S/C9H11ClN2O3/c1-2-11-8(13)5-12-9(14)6-3-4-7(10)15-6/h3-4H,2,5H2,1H3,(H,11,13)(H,12,14)
InChIKeyXEMJLHJZZKPGMW-UHFFFAOYSA-N
MW230.65 g/mol
LogP0.80
Rot. Bonds4

About 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide

5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide (PubChem CID 103606891) has the molecular formula C9H11ClN2O3 and a molecular weight of 230.65 g/mol. Its IUPAC name is 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide
PubChem CID103606891
Molecular FormulaC9H11ClN2O3
Molecular Weight230.65 g/mol
Exact Mass230.05
IUPAC Name5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide
SMILESCCNC(=O)CNC(=O)c1ccc(Cl)o1
InChIInChI=1S/C9H11ClN2O3/c1-2-11-8(13)5-12-9(14)6-3-4-7(10)15-6/h3-4H,2,5H2,1H3,(H,11,13)(H,12,14)
InChIKeyXEMJLHJZZKPGMW-UHFFFAOYSA-N
XLogP0.80
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.65
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-chlorophenyl)-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide
CID 18145739
5-chloro-N-[2-(cyclopropylamino)-2-oxoethyl]furan-2-carboxamide
CID 103606885
5-chloro-N-[[4-(ethylcarbamoyl)phenyl]methyl]furan-2-carboxamide
CID 86990026
5-chloro-N-[2-(ethylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119508521
5-chloro-N-(2-chloropropyl)furan-2-carboxamide
CID 106689974
N-(2-bromobutyl)-5-chlorofuran-2-carboxamide
CID 106690154
5-chloro-N-[2-(propylamino)ethyl]furan-2-carboxamide
CID 62659012
5-(4-acetylphenyl)-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide
CID 18145659
5-chloro-N-(2-hydroxy-2-methylpropyl)furan-2-carboxamide
CID 65109429
4-(bromomethyl)-N-[2-(ethylamino)-2-oxoethyl]benzamide
CID 102851007
5-bromo-N-[2-(2-methylprop-2-enylamino)-2-oxoethyl]furan-2-carboxamide
CID 114618727
5-chloro-N-[2-(chloromethyl)-2-ethylbutyl]furan-2-carboxamide
CID 106253138

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide?
The IUPAC name of 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide (CID 103606891) is 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide is CCNC(=O)CNC(=O)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide?
The InChIKey is XEMJLHJZZKPGMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O3/c1-2-11-8(13)5-12-9(14)6-3-4-7(10)15-6/h3-4H,2,5H2,1H3,(H,11,13)(H,12,14).
What are the key properties of 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide?
5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide has a molecular weight of 230.65 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide is sourced from PubChem (CID 103606891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).