N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide

C20H17ClN2O4 — CID 23798450

IUPACN-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide
SMILESCc1ccc(OCC(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)cc1
InChIInChI=1S/C20H17ClN2O4/c1-13-4-7-15(8-5-13)27-12-19(24)22-14-6-9-17(16(21)11-14)23-20(25)18-3-2-10-26-18/h2-11H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyKFPLGLVHZUBXMN-UHFFFAOYSA-N
MW384.82 g/mol
LogP4.51
Rot. Bonds6

About N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide

N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide (PubChem CID 23798450) has the molecular formula C20H17ClN2O4 and a molecular weight of 384.82 g/mol. Its IUPAC name is N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide
PubChem CID23798450
Molecular FormulaC20H17ClN2O4
Molecular Weight384.82 g/mol
Exact Mass384.09
IUPAC NameN-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide
SMILESCc1ccc(OCC(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)cc1
InChIInChI=1S/C20H17ClN2O4/c1-13-4-7-15(8-5-13)27-12-19(24)22-14-6-9-17(16(21)11-14)23-20(25)18-3-2-10-26-18/h2-11H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyKFPLGLVHZUBXMN-UHFFFAOYSA-N
XLogP4.51
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.82
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[2-(2-chloroanilino)-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 55307259
N-[2-chloro-4-[(4-methylphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide
CID 60544197
N-[5-[[2-(3,5-dimethylphenoxy)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide
CID 9324992
N-[4-[[2-(2,4-dichlorophenoxy)acetyl]amino]-2-methylphenyl]furan-2-carboxamide
CID 1086039
N-[3-[[2-(3,4-dichlorophenoxy)acetyl]amino]phenyl]furan-2-carboxamide
CID 37026412
N-[2-chloro-5-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide
CID 5346300
N-[4-[[2-(2-chlorophenoxy)acetyl]amino]-2-methoxyphenyl]furan-2-carboxamide
CID 3161355
N-[4-[(4-amino-3-methoxybutanoyl)amino]-2-chlorophenyl]furan-2-carboxamide
CID 120589860
N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 29204883
N-[3-chloro-4-[(2-phenylacetyl)amino]phenyl]furan-2-carboxamide
CID 3132085
N-[6-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide
CID 17127421
2-chloro-N-[2-methoxy-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]benzamide
CID 4014221

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide (CID 23798450) is N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide is Cc1ccc(OCC(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)cc1.
What is the InChIKey of N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide?
The InChIKey is KFPLGLVHZUBXMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4/c1-13-4-7-15(8-5-13)27-12-19(24)22-14-6-9-17(16(21)11-14)23-20(25)18-3-2-10-26-18/h2-11H,12H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide?
N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide has a molecular weight of 384.82 g/mol, XLogP of 4.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 23798450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).