N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide

C23H19NO3 — CID 2877098

IUPACN-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC(c1ccco1)c1c(O)ccc2ccccc12
InChIInChI=1S/C23H19NO3/c25-19-13-12-17-9-4-5-10-18(17)22(19)23(20-11-6-14-27-20)24-21(26)15-16-7-2-1-3-8-16/h1-14,23,25H,15H2,(H,24,26)
InChIKeyPFRWQHNNDMDEFX-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.59
Rot. Bonds5

About N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide

N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide (PubChem CID 2877098) has the molecular formula C23H19NO3 and a molecular weight of 357.41 g/mol. Its IUPAC name is N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide
PubChem CID2877098
Molecular FormulaC23H19NO3
Molecular Weight357.41 g/mol
Exact Mass357.14
IUPAC NameN-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC(c1ccco1)c1c(O)ccc2ccccc12
InChIInChI=1S/C23H19NO3/c25-19-13-12-17-9-4-5-10-18(17)22(19)23(20-11-6-14-27-20)24-21(26)15-16-7-2-1-3-8-16/h1-14,23,25H,15H2,(H,24,26)
InChIKeyPFRWQHNNDMDEFX-UHFFFAOYSA-N
XLogP4.59
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

Analyze N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide?
The IUPAC name of N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide (CID 2877098) is N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide.
What is the SMILES notation for N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide?
The canonical SMILES for N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide is O=C(Cc1ccccc1)NC(c1ccco1)c1c(O)ccc2ccccc12.
What is the InChIKey of N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide?
The InChIKey is PFRWQHNNDMDEFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO3/c25-19-13-12-17-9-4-5-10-18(17)22(19)23(20-11-6-14-27-20)24-21(26)15-16-7-2-1-3-8-16/h1-14,23,25H,15H2,(H,24,26).
What are the key properties of N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide?
N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide has a molecular weight of 357.41 g/mol, XLogP of 4.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl-(2-hydroxynaphthalen-1-yl)methyl]-2-phenylacetamide is sourced from PubChem (CID 2877098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).