N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide

C19H15ClFNO3 — CID 16650857

IUPACN-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
SMILESCOc1ccc(Cl)c(NC(=O)c2cc(-c3ccc(F)cc3)oc2C)c1
InChIInChI=1S/C19H15ClFNO3/c1-11-15(10-18(25-11)12-3-5-13(21)6-4-12)19(23)22-17-9-14(24-2)7-8-16(17)20/h3-10H,1-2H3,(H,22,23)
InChIKeyAEZJPKAAWJIAHE-UHFFFAOYSA-N
MW359.78 g/mol
LogP5.31
Rot. Bonds4

About N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide

N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide (PubChem CID 16650857) has the molecular formula C19H15ClFNO3 and a molecular weight of 359.78 g/mol. Its IUPAC name is N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
PubChem CID16650857
Molecular FormulaC19H15ClFNO3
Molecular Weight359.78 g/mol
Exact Mass359.07
IUPAC NameN-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
SMILESCOc1ccc(Cl)c(NC(=O)c2cc(-c3ccc(F)cc3)oc2C)c1
InChIInChI=1S/C19H15ClFNO3/c1-11-15(10-18(25-11)12-3-5-13(21)6-4-12)19(23)22-17-9-14(24-2)7-8-16(17)20/h3-10H,1-2H3,(H,22,23)
InChIKeyAEZJPKAAWJIAHE-UHFFFAOYSA-N
XLogP5.31
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.78
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3,4-dichlorophenyl)-N-(4-methoxyphenyl)-2-methylfuran-3-carboxamide
CID 2958681
N-(2-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
CID 2742801
N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 2742876
N-(2,4-dichlorophenyl)-5-(3,4-dichlorophenyl)-2-methylfuran-3-carboxamide
CID 18809187
N-(2-chloro-5-methoxyphenyl)-2,5-dihydroxybenzamide
CID 107722765
5-(4-chlorophenyl)-N-(3-fluorophenyl)-2-methylfuran-3-carboxamide
CID 16651382
butyl 4-[[5-(4-fluorophenyl)-2-methylfuran-3-carbonyl]amino]benzoate
CID 16650910
2-methyl-N,5-bis(4-methylphenyl)furan-3-carboxamide
CID 16650715
4-bromo-N-(2-chloro-5-methoxyphenyl)-2-methoxybenzamide
CID 78987859
2-amino-N-(2-chloro-5-methylphenyl)-5-methoxybenzamide
CID 107624036
5-amino-N-(2-chloro-5-methoxyphenyl)-1-methylpyrazole-4-carboxamide
CID 115330655
4-amino-N-(2-chloro-5-methoxyphenyl)-6-methylpyridine-3-carboxamide
CID 81242456

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide (CID 16650857) is N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide is COc1ccc(Cl)c(NC(=O)c2cc(-c3ccc(F)cc3)oc2C)c1.
What is the InChIKey of N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide?
The InChIKey is AEZJPKAAWJIAHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFNO3/c1-11-15(10-18(25-11)12-3-5-13(21)6-4-12)19(23)22-17-9-14(24-2)7-8-16(17)20/h3-10H,1-2H3,(H,22,23).
What are the key properties of N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide?
N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide has a molecular weight of 359.78 g/mol, XLogP of 5.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 16650857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).