2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide

C12H6Cl2N2O2 — CID 106684843

IUPAC2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide
SMILESN#Cc1ccc(Cl)cc1NC(=O)c1ccoc1Cl
InChIInChI=1S/C12H6Cl2N2O2/c13-8-2-1-7(6-15)10(5-8)16-12(17)9-3-4-18-11(9)14/h1-5H,(H,16,17)
InChIKeyNCUOZJWQQWPNRK-UHFFFAOYSA-N
MW281.10 g/mol
LogP3.71
Rot. Bonds2

About 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide

2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide (PubChem CID 106684843) has the molecular formula C12H6Cl2N2O2 and a molecular weight of 281.10 g/mol. Its IUPAC name is 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide
PubChem CID106684843
Molecular FormulaC12H6Cl2N2O2
Molecular Weight281.10 g/mol
Exact Mass279.98
IUPAC Name2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide
SMILESN#Cc1ccc(Cl)cc1NC(=O)c1ccoc1Cl
InChIInChI=1S/C12H6Cl2N2O2/c13-8-2-1-7(6-15)10(5-8)16-12(17)9-3-4-18-11(9)14/h1-5H,(H,16,17)
InChIKeyNCUOZJWQQWPNRK-UHFFFAOYSA-N
XLogP3.71
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.10
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(5-chloro-2-cyanophenyl)-5-hydroxybenzamide
CID 106501019
2-chloro-N-(4-chloro-2-fluorophenyl)furan-3-carboxamide
CID 106685654
N-(5-chloro-2-cyanophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 60710472
N-(5-chloro-2-cyanophenyl)-2,5-dimethylfuran-3-carboxamide
CID 60628705
3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide
CID 66463010
5-chloro-2-[(2-chlorofuran-3-carbonyl)amino]benzoic acid
CID 106683314
N-(5-chloro-2-cyanophenyl)-3-hydroxypyridine-4-carboxamide
CID 81446338
2-chloro-N-(5-chloro-2-cyanophenyl)-4-methylbenzamide
CID 106861258
4-chloro-N-(5-chloro-2-cyanophenyl)-6-methylpyridine-3-carboxamide
CID 81226633
N-(5-chloro-2-cyanophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105386639
N-(5-chloro-2-cyanophenyl)-4-methylbenzamide
CID 60628684
N-(5-chloro-2-cyanophenyl)-4-fluorobenzamide
CID 60628744

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide (CID 106684843) is 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide is N#Cc1ccc(Cl)cc1NC(=O)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide?
The InChIKey is NCUOZJWQQWPNRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2N2O2/c13-8-2-1-7(6-15)10(5-8)16-12(17)9-3-4-18-11(9)14/h1-5H,(H,16,17).
What are the key properties of 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide?
2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide has a molecular weight of 281.10 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide is sourced from PubChem (CID 106684843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).