3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide

C16H19NO3 — CID 19225996

IUPAC3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide
SMILESCCOc1ccc(CCC(=O)NCc2ccco2)cc1
InChIInChI=1S/C16H19NO3/c1-2-19-14-8-5-13(6-9-14)7-10-16(18)17-12-15-4-3-11-20-15/h3-6,8-9,11H,2,7,10,12H2,1H3,(H,17,18)
InChIKeyCXTZKNSHOWJSPK-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.93
Rot. Bonds7

About 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide

3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide (PubChem CID 19225996) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide
PubChem CID19225996
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide
SMILESCCOc1ccc(CCC(=O)NCc2ccco2)cc1
InChIInChI=1S/C16H19NO3/c1-2-19-14-8-5-13(6-9-14)7-10-16(18)17-12-15-4-3-11-20-15/h3-6,8-9,11H,2,7,10,12H2,1H3,(H,17,18)
InChIKeyCXTZKNSHOWJSPK-UHFFFAOYSA-N
XLogP2.93
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 9079933
2-(4-ethoxyphenyl)sulfanyl-N-(furan-2-ylmethyl)acetamide
CID 9401109
3-(2-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide
CID 78805596
2-(3-ethoxyphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 112977702
5-[(4-ethoxyphenoxy)methyl]-N-(furan-2-ylmethyl)furan-2-carboxamide
CID 19413326
(4-ethoxyphenyl)methyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]-methylazanium
CID 8024025
2-[(4-ethoxyphenyl)methyl-methylamino]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 4818761
2-[[[(4-ethoxyphenyl)methyl-methylamino]-(ethylamino)methylidene]amino]-N-(furan-2-ylmethyl)acetamide
CID 111275303
2-[(4-ethoxyphenyl)sulfonylmethylamino]-N-(furan-2-ylmethyl)acetamide
CID 21156771
N-[4-(4-ethoxyphenoxy)phenyl]-3-(furan-2-yl)propanamide
CID 26242410
N'-(furan-2-ylmethyl)-N-propylbutanediamide
CID 4024516
N-[(4-ethoxyphenyl)methyl]-3-(furan-2-yl)-N-methylpropanamide
CID 78779679

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide (CID 19225996) is 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide is CCOc1ccc(CCC(=O)NCc2ccco2)cc1.
What is the InChIKey of 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide?
The InChIKey is CXTZKNSHOWJSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-2-19-14-8-5-13(6-9-14)7-10-16(18)17-12-15-4-3-11-20-15/h3-6,8-9,11H,2,7,10,12H2,1H3,(H,17,18).
What are the key properties of 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide?
3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide has a molecular weight of 273.33 g/mol, XLogP of 2.93, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenyl)-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 19225996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).