4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide

C14H14N2O4 — CID 823810

IUPAC4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide
SMILESCc1oc(C(N)=O)cc1COc1ccc(C(N)=O)cc1
InChIInChI=1S/C14H14N2O4/c1-8-10(6-12(20-8)14(16)18)7-19-11-4-2-9(3-5-11)13(15)17/h2-6H,7H2,1H3,(H2,15,17)(H2,16,18)
InChIKeyFXHAVHODESZKMG-UHFFFAOYSA-N
MW274.28 g/mol
LogP1.36
Rot. Bonds5

About 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide

4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide (PubChem CID 823810) has the molecular formula C14H14N2O4 and a molecular weight of 274.28 g/mol. Its IUPAC name is 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide.

Molecular Properties

Compound Name4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide
PubChem CID823810
Molecular FormulaC14H14N2O4
Molecular Weight274.28 g/mol
Exact Mass274.10
IUPAC Name4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide
SMILESCc1oc(C(N)=O)cc1COc1ccc(C(N)=O)cc1
InChIInChI=1S/C14H14N2O4/c1-8-10(6-12(20-8)14(16)18)7-19-11-4-2-9(3-5-11)13(15)17/h2-6H,7H2,1H3,(H2,15,17)(H2,16,18)
InChIKeyFXHAVHODESZKMG-UHFFFAOYSA-N
XLogP1.36
TPSA108.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(diaminomethylidene)-5-(5-fluoro-2-methoxyphenyl)furan-2-carboxamide
CID 11391762
4-[[4-(4-methoxyphenyl)phenoxy]methyl]-5-methyl-N-methylsulfonylfuran-2-carboxamide
CID 18444628
N-[4-(4'-Methoxy-biphenyl-4-yloxymethyl)-5-methyl-furan-2-carbonyl]-dimethylamino-sulphonamide
CID 18444679
4-[[4-(4-methoxyphenyl)phenoxy]methyl]-5-methyl-N-propylsulfonylfuran-2-carboxamide
CID 58824196
N-(diaminomethylene)-3-methyl-5-phenylfuran-2-carboxamide
CID 44432244
N'-[2-(4-methoxyphenyl)acetyl]furan-2-carbohydrazide
CID 774120
N-[5-(3-Methoxy-phenyl)-furan-2-carbonyl]-guanidine
CID 11207657
N-[5-(2-Methoxy-phenyl)-furan-2-carbonyl]-guanidine
CID 11242380
N-[5-(2-Ethoxy-phenyl)-furan-2-carbonyl]-guanidine
CID 11311839
N-[5-(2-Isopropoxy-phenyl)-furan-2-carbonyl]-guanidine
CID 11358162
N-[5-(2,5-Dimethoxy-phenyl)-furan-2-carbonyl]-guanidine
CID 11449112
(E)-N-Hydroxy-5-styrylfuran-2-carboxamide
CID 44562038

Frequently Asked Questions

What is the IUPAC name of 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide?
The IUPAC name of 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide (CID 823810) is 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide.
What is the SMILES notation for 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide?
The canonical SMILES for 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide is Cc1oc(C(N)=O)cc1COc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide?
The InChIKey is FXHAVHODESZKMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4/c1-8-10(6-12(20-8)14(16)18)7-19-11-4-2-9(3-5-11)13(15)17/h2-6H,7H2,1H3,(H2,15,17)(H2,16,18).
What are the key properties of 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide?
4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide has a molecular weight of 274.28 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-carbamoylphenoxy)methyl]-5-methylfuran-2-carboxamide is sourced from PubChem (CID 823810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).