N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide

C19H16N2O4 — CID 99824184

IUPACN-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)co1
InChIInChI=1S/C19H16N2O4/c1-12-10-13(11-24-12)19(23)21-14-6-8-15(9-7-14)25-17-5-3-2-4-16(17)18(20)22/h2-11H,1H3,(H2,20,22)(H,21,23)
InChIKeyVUAVZWNQBKPUJR-UHFFFAOYSA-N
MW336.35 g/mol
LogP3.73
Rot. Bonds5

About N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide

N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide (PubChem CID 99824184) has the molecular formula C19H16N2O4 and a molecular weight of 336.35 g/mol. Its IUPAC name is N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide
PubChem CID99824184
Molecular FormulaC19H16N2O4
Molecular Weight336.35 g/mol
Exact Mass336.11
IUPAC NameN-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)co1
InChIInChI=1S/C19H16N2O4/c1-12-10-13(11-24-12)19(23)21-14-6-8-15(9-7-14)25-17-5-3-2-4-16(17)18(20)22/h2-11H,1H3,(H2,20,22)(H,21,23)
InChIKeyVUAVZWNQBKPUJR-UHFFFAOYSA-N
XLogP3.73
TPSA94.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.35
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide?
The IUPAC name of N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide (CID 99824184) is N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide.
What is the SMILES notation for N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide?
The canonical SMILES for N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide is Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)co1.
What is the InChIKey of N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide?
The InChIKey is VUAVZWNQBKPUJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O4/c1-12-10-13(11-24-12)19(23)21-14-6-8-15(9-7-14)25-17-5-3-2-4-16(17)18(20)22/h2-11H,1H3,(H2,20,22)(H,21,23).
What are the key properties of N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide?
N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide has a molecular weight of 336.35 g/mol, XLogP of 3.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-carbamoylphenoxy)phenyl]-5-methylfuran-3-carboxamide is sourced from PubChem (CID 99824184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).