N-benzyl-3-(5-methylfuran-2-yl)propanamide

C15H17NO2 — CID 827173

IUPACN-benzyl-3-(5-methylfuran-2-yl)propanamide
SMILESCc1ccc(CCC(=O)NCc2ccccc2)o1
InChIInChI=1S/C15H17NO2/c1-12-7-8-14(18-12)9-10-15(17)16-11-13-5-3-2-4-6-13/h2-8H,9-11H2,1H3,(H,16,17)
InChIKeyAYZOLGZMOCTXNC-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.84
Rot. Bonds5

About N-benzyl-3-(5-methylfuran-2-yl)propanamide

N-benzyl-3-(5-methylfuran-2-yl)propanamide (PubChem CID 827173) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is N-benzyl-3-(5-methylfuran-2-yl)propanamide.

Molecular Properties

Compound NameN-benzyl-3-(5-methylfuran-2-yl)propanamide
PubChem CID827173
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC NameN-benzyl-3-(5-methylfuran-2-yl)propanamide
SMILESCc1ccc(CCC(=O)NCc2ccccc2)o1
InChIInChI=1S/C15H17NO2/c1-12-7-8-14(18-12)9-10-15(17)16-11-13-5-3-2-4-6-13/h2-8H,9-11H2,1H3,(H,16,17)
InChIKeyAYZOLGZMOCTXNC-UHFFFAOYSA-N
XLogP2.84
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-benzyl-3-(5-methylfuran-2-yl)propanamide 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-benzyl-3-(5-methylfuran-2-yl)propanamide?
The IUPAC name of N-benzyl-3-(5-methylfuran-2-yl)propanamide (CID 827173) is N-benzyl-3-(5-methylfuran-2-yl)propanamide.
What is the SMILES notation for N-benzyl-3-(5-methylfuran-2-yl)propanamide?
The canonical SMILES for N-benzyl-3-(5-methylfuran-2-yl)propanamide is Cc1ccc(CCC(=O)NCc2ccccc2)o1.
What is the InChIKey of N-benzyl-3-(5-methylfuran-2-yl)propanamide?
The InChIKey is AYZOLGZMOCTXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-12-7-8-14(18-12)9-10-15(17)16-11-13-5-3-2-4-6-13/h2-8H,9-11H2,1H3,(H,16,17).
What are the key properties of N-benzyl-3-(5-methylfuran-2-yl)propanamide?
N-benzyl-3-(5-methylfuran-2-yl)propanamide has a molecular weight of 243.31 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(5-methylfuran-2-yl)propanamide is sourced from PubChem (CID 827173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).