2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide

C21H21NO3 — CID 2864448

IUPAC2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide
SMILESCCCOc1cccc(NC(=O)c2cc(-c3ccccc3)oc2C)c1
InChIInChI=1S/C21H21NO3/c1-3-12-24-18-11-7-10-17(13-18)22-21(23)19-14-20(25-15(19)2)16-8-5-4-6-9-16/h4-11,13-14H,3,12H2,1-2H3,(H,22,23)
InChIKeyIIHKAKMNBCJEGC-UHFFFAOYSA-N
MW335.40 g/mol
LogP5.30
Rot. Bonds6

About 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide

2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide (PubChem CID 2864448) has the molecular formula C21H21NO3 and a molecular weight of 335.40 g/mol. Its IUPAC name is 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide
PubChem CID2864448
Molecular FormulaC21H21NO3
Molecular Weight335.40 g/mol
Exact Mass335.15
IUPAC Name2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide
SMILESCCCOc1cccc(NC(=O)c2cc(-c3ccccc3)oc2C)c1
InChIInChI=1S/C21H21NO3/c1-3-12-24-18-11-7-10-17(13-18)22-21(23)19-14-20(25-15(19)2)16-8-5-4-6-9-16/h4-11,13-14H,3,12H2,1-2H3,(H,22,23)
InChIKeyIIHKAKMNBCJEGC-UHFFFAOYSA-N
XLogP5.30
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.40
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide
CID 43175539
5-methyl-N-(3-propoxyphenyl)furan-2-carboxamide
CID 2260679
butyl 4-[(2-methyl-5-phenylfuran-3-carbonyl)amino]benzoate
CID 16650686
N-(4-butylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 16650691
N-[3-(2-phenoxyethoxy)phenyl]-4-propoxybenzamide
CID 17123567
2-propan-2-yloxy-N-(3-propoxyphenyl)benzamide
CID 17096796
N-(4-carbamoylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 17015561
2,4-dimethyl-N-(3-propoxyphenyl)furan-3-carboxamide
CID 13019988
N-(4-iodophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 1340506
4-(phenylcarbamoylamino)-N-(3-propoxyphenyl)benzamide
CID 38825151
5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide
CID 141116560
2-(2-methylpropoxy)-N-(3-propoxyphenyl)benzamide
CID 17096753

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide?
The IUPAC name of 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide (CID 2864448) is 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide.
What is the SMILES notation for 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide?
The canonical SMILES for 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide is CCCOc1cccc(NC(=O)c2cc(-c3ccccc3)oc2C)c1.
What is the InChIKey of 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide?
The InChIKey is IIHKAKMNBCJEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO3/c1-3-12-24-18-11-7-10-17(13-18)22-21(23)19-14-20(25-15(19)2)16-8-5-4-6-9-16/h4-11,13-14H,3,12H2,1-2H3,(H,22,23).
What are the key properties of 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide?
2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide has a molecular weight of 335.40 g/mol, XLogP of 5.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide is sourced from PubChem (CID 2864448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).