N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide

C19H20N2O3 — CID 2971215

IUPACN-[3-(benzylcarbamoyl)phenyl]oxolane-2-carboxamide
SMILESC1CC(OC1)C(=O)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3
InChIInChI=1S/C19H20N2O3/c22-18(20-13-14-6-2-1-3-7-14)15-8-4-9-16(12-15)21-19(23)17-10-5-11-24-17/h1-4,6-9,12,17H,5,10-11,13H2,(H,20,22)(H,21,23)
InChIKeySRHDIEONAZHZIV-UHFFFAOYSA-N
MW324.40 g/mol
LogP2.30
Rot. Bonds5

About N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide

N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide (PubChem CID 2971215) has the molecular formula C19H20N2O3 and a molecular weight of 324.40 g/mol. Its IUPAC name is N-[3-(benzylcarbamoyl)phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide
PubChem CID2971215
Molecular FormulaC19H20N2O3
Molecular Weight324.40 g/mol
Exact Mass324.15
IUPAC NameN-[3-(benzylcarbamoyl)phenyl]oxolane-2-carboxamide
SMILESC1CC(OC1)C(=O)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3
InChIInChI=1S/C19H20N2O3/c22-18(20-13-14-6-2-1-3-7-14)15-8-4-9-16(12-15)21-19(23)17-10-5-11-24-17/h1-4,6-9,12,17H,5,10-11,13H2,(H,20,22)(H,21,23)
InChIKeySRHDIEONAZHZIV-UHFFFAOYSA-N
XLogP2.30
TPSA67.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity434

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.40
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide?
The IUPAC name of N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide (CID 2971215) is N-[3-(benzylcarbamoyl)phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide?
The canonical SMILES for N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide is C1CC(OC1)C(=O)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3.
What is the InChIKey of N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide?
The InChIKey is SRHDIEONAZHZIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c22-18(20-13-14-6-2-1-3-7-14)15-8-4-9-16(12-15)21-19(23)17-10-5-11-24-17/h1-4,6-9,12,17H,5,10-11,13H2,(H,20,22)(H,21,23).
What are the key properties of N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide?
N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide has a molecular weight of 324.40 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(benzylcarbamoyl)phenyl]tetrahydrofuran-2-carboxamide is sourced from PubChem (CID 2971215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).