3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide

C17H21NO2 — CID 942220

IUPAC3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide
SMILESCCc1ccc(NC(=O)CCc2ccc(CC)o2)cc1
InChIInChI=1S/C17H21NO2/c1-3-13-5-7-14(8-6-13)18-17(19)12-11-16-10-9-15(4-2)20-16/h5-10H,3-4,11-12H2,1-2H3,(H,18,19)
InChIKeyDUIFLQRJORQCQP-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.98
Rot. Bonds6

About 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide

3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide (PubChem CID 942220) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide.

Molecular Properties

Compound Name3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide
PubChem CID942220
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide
SMILESCCc1ccc(NC(=O)CCc2ccc(CC)o2)cc1
InChIInChI=1S/C17H21NO2/c1-3-13-5-7-14(8-6-13)18-17(19)12-11-16-10-9-15(4-2)20-16/h5-10H,3-4,11-12H2,1-2H3,(H,18,19)
InChIKeyDUIFLQRJORQCQP-UHFFFAOYSA-N
XLogP3.98
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide?
The IUPAC name of 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide (CID 942220) is 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide.
What is the SMILES notation for 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide?
The canonical SMILES for 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide is CCc1ccc(NC(=O)CCc2ccc(CC)o2)cc1.
What is the InChIKey of 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide?
The InChIKey is DUIFLQRJORQCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-3-13-5-7-14(8-6-13)18-17(19)12-11-16-10-9-15(4-2)20-16/h5-10H,3-4,11-12H2,1-2H3,(H,18,19).
What are the key properties of 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide?
3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide has a molecular weight of 271.36 g/mol, XLogP of 3.98, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethylfuran-2-yl)-N-(4-ethylphenyl)propanamide is sourced from PubChem (CID 942220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).