5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide

C13H12ClNO2 — CID 51188744

IUPAC5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide
SMILESCCNC(=O)c1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C13H12ClNO2/c1-2-15-13(16)12-8-7-11(17-12)9-5-3-4-6-10(9)14/h3-8H,2H2,1H3,(H,15,16)
InChIKeyNCKIDNSWIZQQNT-UHFFFAOYSA-N
MW249.70 g/mol
LogP3.35
Rot. Bonds3

About 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide

5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide (PubChem CID 51188744) has the molecular formula C13H12ClNO2 and a molecular weight of 249.70 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide.

Molecular Properties

Compound Name5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide
PubChem CID51188744
Molecular FormulaC13H12ClNO2
Molecular Weight249.70 g/mol
Exact Mass249.06
IUPAC Name5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide
SMILESCCNC(=O)c1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C13H12ClNO2/c1-2-15-13(16)12-8-7-11(17-12)9-5-3-4-6-10(9)14/h3-8H,2H2,1H3,(H,15,16)
InChIKeyNCKIDNSWIZQQNT-UHFFFAOYSA-N
XLogP3.35
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.70
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-chlorophenyl)-N-propylfuran-2-carboxamide
CID 5262410
5-(2-chlorophenyl)-N-[2-(ethylamino)ethyl]furan-2-carboxamide
CID 119505945
5-(2-chlorophenyl)-N-(2-hydroxyethyl)furan-2-carboxamide
CID 78800704
5-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]furan-2-carboxamide
CID 9083579
5-(2-chlorophenyl)-N-[2-(methylamino)propyl]furan-2-carboxamide;hydrochloride
CID 120827077
N-(4-amino-4-oxobutyl)-5-(2-chlorophenyl)furan-2-carboxamide
CID 56812733
(2R)-2-amino-3-[[5-(2-chlorophenyl)furan-2-carbonyl]amino]propanoic acid
CID 166627868
5-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]furan-2-carboxamide
CID 9080736
methyl 6-[[5-(2-chlorophenyl)furan-2-carbonyl]amino]hexanoate
CID 134014900
5-(2-chlorophenyl)-N-(2-pyridin-4-ylethyl)furan-2-carboxamide
CID 70709024
5-(2-chlorophenyl)-N-(5-methylhexan-2-yl)furan-2-carboxamide
CID 16560702
5-(2-chlorophenyl)-N-[2-(2-ethylimidazol-1-yl)ethyl]furan-2-carboxamide
CID 70717961

Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide?
The IUPAC name of 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide (CID 51188744) is 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide.
What is the SMILES notation for 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide?
The canonical SMILES for 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide is CCNC(=O)c1ccc(-c2ccccc2Cl)o1.
What is the InChIKey of 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide?
The InChIKey is NCKIDNSWIZQQNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO2/c1-2-15-13(16)12-8-7-11(17-12)9-5-3-4-6-10(9)14/h3-8H,2H2,1H3,(H,15,16).
What are the key properties of 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide?
5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide has a molecular weight of 249.70 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide is sourced from PubChem (CID 51188744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).