5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide

C17H15ClN2O4 — CID 19446268

IUPAC5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide
SMILESCc1noc(C)c1NC(=O)c1ccc(COc2cccc(Cl)c2)o1
InChIInChI=1S/C17H15ClN2O4/c1-10-16(11(2)24-20-10)19-17(21)15-7-6-14(23-15)9-22-13-5-3-4-12(18)8-13/h3-8H,9H2,1-2H3,(H,19,21)
InChIKeyWUDJYZAVTHNOGY-UHFFFAOYSA-N
MW346.77 g/mol
LogP4.37
Rot. Bonds5

About 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide

5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide (PubChem CID 19446268) has the molecular formula C17H15ClN2O4 and a molecular weight of 346.77 g/mol. Its IUPAC name is 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide
PubChem CID19446268
Molecular FormulaC17H15ClN2O4
Molecular Weight346.77 g/mol
Exact Mass346.07
IUPAC Name5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide
SMILESCc1noc(C)c1NC(=O)c1ccc(COc2cccc(Cl)c2)o1
InChIInChI=1S/C17H15ClN2O4/c1-10-16(11(2)24-20-10)19-17(21)15-7-6-14(23-15)9-22-13-5-3-4-12(18)8-13/h3-8H,9H2,1-2H3,(H,19,21)
InChIKeyWUDJYZAVTHNOGY-UHFFFAOYSA-N
XLogP4.37
TPSA77.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.77
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide
CID 19446073
5-[(3-chlorophenoxy)methyl]-N-(3,4-dichlorophenyl)furan-2-carboxamide
CID 19446098
5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide
CID 35526540
N-(2,6-dimethylphenyl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
CID 19465597
5-[(3-chlorophenoxy)methyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 19446135
5-[(3-chlorophenoxy)methyl]-N-[(2-methylpyrazol-3-yl)methyl]furan-2-carboxamide
CID 19292519
5-[(3-chlorophenoxy)methyl]-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19446189
4-[[5-[(3-chlorophenoxy)methyl]furan-2-carbonyl]amino]-1-ethylpyrazole-3-carboxamide
CID 19412473
N-[3-(4-chloro-3,5-dimethylpyrazol-1-yl)propyl]-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide
CID 19295430
5-[(3-chlorophenoxy)methyl]-N-[(3,4-diethoxyphenyl)methyl]furan-2-carboxamide
CID 19446192
butyl 4-[[5-[(3-chlorophenoxy)methyl]furan-2-carbonyl]amino]benzoate
CID 4549301
5-[(3-chlorophenoxy)methyl]-N-(4-methoxy-2-nitrophenyl)furan-2-carboxamide
CID 19446107

Frequently Asked Questions

What is the IUPAC name of 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide?
The IUPAC name of 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide (CID 19446268) is 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide.
What is the SMILES notation for 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide?
The canonical SMILES for 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide is Cc1noc(C)c1NC(=O)c1ccc(COc2cccc(Cl)c2)o1.
What is the InChIKey of 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide?
The InChIKey is WUDJYZAVTHNOGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O4/c1-10-16(11(2)24-20-10)19-17(21)15-7-6-14(23-15)9-22-13-5-3-4-12(18)8-13/h3-8H,9H2,1-2H3,(H,19,21).
What are the key properties of 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide?
5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide has a molecular weight of 346.77 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide is sourced from PubChem (CID 19446268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).