N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide

C19H12Cl2N2O2 — CID 7464368

IUPACN-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide
SMILESCc1oc(-c2ccc(Cl)cc2Cl)cc1C(=O)Nc1ccccc1C#N
InChIInChI=1S/C19H12Cl2N2O2/c1-11-15(19(24)23-17-5-3-2-4-12(17)10-22)9-18(25-11)14-7-6-13(20)8-16(14)21/h2-9H,1H3,(H,23,24)
InChIKeyLKCNCMLGWHXGLV-UHFFFAOYSA-N
MW371.22 g/mol
LogP5.69
Rot. Bonds3

About N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide

N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide (PubChem CID 7464368) has the molecular formula C19H12Cl2N2O2 and a molecular weight of 371.22 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide
PubChem CID7464368
Molecular FormulaC19H12Cl2N2O2
Molecular Weight371.22 g/mol
Exact Mass370.03
IUPAC NameN-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide
SMILESCc1oc(-c2ccc(Cl)cc2Cl)cc1C(=O)Nc1ccccc1C#N
InChIInChI=1S/C19H12Cl2N2O2/c1-11-15(19(24)23-17-5-3-2-4-12(17)10-22)9-18(25-11)14-7-6-13(20)8-16(14)21/h2-9H,1H3,(H,23,24)
InChIKeyLKCNCMLGWHXGLV-UHFFFAOYSA-N
XLogP5.69
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.22
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyanophenyl)-5-(3,4-dichlorophenyl)-2-methylfuran-3-carboxamide
CID 18809184
5-chloro-N-(2-cyanophenyl)-2-(methylamino)benzamide
CID 62167777
N-[(2-cyanophenyl)carbamothioyl]-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 22776568
N-(5-chloro-2-cyanophenyl)-2,5-dimethylfuran-3-carboxamide
CID 60628705
N-(2-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
CID 2742801
5-(4-chloro-2-nitrophenyl)-N-(2-ethylphenyl)-2-methylfuran-3-carboxamide
CID 7464341
(E)-N-[(2-cyanophenyl)carbamothioyl]-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide
CID 17103641
N-(2-cyanophenyl)-N'-(2,4-dichlorophenyl)-2,2-dimethylpropanediamide
CID 108970103
N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 2742876
5-(2-chlorophenyl)-N-(2-cyanophenyl)furan-2-carboxamide
CID 944882
N-(2,4-dichlorophenyl)-5-(3,4-dichlorophenyl)-2-methylfuran-3-carboxamide
CID 18809187
1-(5-chloro-2-methylphenyl)-3-(2-cyanophenyl)urea
CID 17180173

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide (CID 7464368) is N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide is Cc1oc(-c2ccc(Cl)cc2Cl)cc1C(=O)Nc1ccccc1C#N.
What is the InChIKey of N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide?
The InChIKey is LKCNCMLGWHXGLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Cl2N2O2/c1-11-15(19(24)23-17-5-3-2-4-12(17)10-22)9-18(25-11)14-7-6-13(20)8-16(14)21/h2-9H,1H3,(H,23,24).
What are the key properties of N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide?
N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide has a molecular weight of 371.22 g/mol, XLogP of 5.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5-(2,4-dichlorophenyl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 7464368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).