N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide

C22H20N2O3 — CID 19454573

IUPACN-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
SMILESCCCc1ccc(OCc2ccc(C(=O)Nc3ccccc3C#N)o2)cc1
InChIInChI=1S/C22H20N2O3/c1-2-5-16-8-10-18(11-9-16)26-15-19-12-13-21(27-19)22(25)24-20-7-4-3-6-17(20)14-23/h3-4,6-13H,2,5,15H2,1H3,(H,24,25)
InChIKeyHUECWCHDFCEQBL-UHFFFAOYSA-N
MW360.41 g/mol
LogP4.94
Rot. Bonds7

About N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide

N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide (PubChem CID 19454573) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
PubChem CID19454573
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC NameN-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
SMILESCCCc1ccc(OCc2ccc(C(=O)Nc3ccccc3C#N)o2)cc1
InChIInChI=1S/C22H20N2O3/c1-2-5-16-8-10-18(11-9-16)26-15-19-12-13-21(27-19)22(25)24-20-7-4-3-6-17(20)14-23/h3-4,6-13H,2,5,15H2,1H3,(H,24,25)
InChIKeyHUECWCHDFCEQBL-UHFFFAOYSA-N
XLogP4.94
TPSA75.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-cyanophenyl)-5-[(4-iodophenoxy)methyl]furan-2-carboxamide
CID 19440079
N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
CID 19454672
5-[(4-cyanophenoxy)methyl]-N-[2-(2-methylpropylcarbamoyl)phenyl]furan-2-carboxamide
CID 86886561
5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide
CID 35529765
N-[2-[[4-(cyanomethyl)phenoxy]methyl]phenyl]-5-ethylfuran-2-carboxamide
CID 55899603
N-(2-chlorophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 7679417
N-(2-hydroxyphenyl)-5-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]furan-2-carboxamide
CID 19455386
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 26774462
N-(3-cyanophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 9245570
methyl 4-[[5-[[2-(trifluoromethyl)phenyl]carbamoyl]furan-2-yl]methoxy]benzoate
CID 19448946
N'-(4-butoxybenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 9219874
N-(2-hydroxyphenyl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19460984

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide (CID 19454573) is N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide is CCCc1ccc(OCc2ccc(C(=O)Nc3ccccc3C#N)o2)cc1.
What is the InChIKey of N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide?
The InChIKey is HUECWCHDFCEQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-2-5-16-8-10-18(11-9-16)26-15-19-12-13-21(27-19)22(25)24-20-7-4-3-6-17(20)14-23/h3-4,6-13H,2,5,15H2,1H3,(H,24,25).
What are the key properties of N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide?
N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide has a molecular weight of 360.41 g/mol, XLogP of 4.94, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 19454573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).