2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide

C17H21NO3 — CID 126810206

IUPAC2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide
SMILESCOc1ccc(C(C)C(C)NC(=O)Cc2ccoc2)cc1
InChIInChI=1S/C17H21NO3/c1-12(15-4-6-16(20-3)7-5-15)13(2)18-17(19)10-14-8-9-21-11-14/h4-9,11-13H,10H2,1-3H3,(H,18,19)
InChIKeyOBQMXHQEZZDCSO-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.14
Rot. Bonds6

About 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide

2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide (PubChem CID 126810206) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide.

Molecular Properties

Compound Name2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide
PubChem CID126810206
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC Name2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide
SMILESCOc1ccc(C(C)C(C)NC(=O)Cc2ccoc2)cc1
InChIInChI=1S/C17H21NO3/c1-12(15-4-6-16(20-3)7-5-15)13(2)18-17(19)10-14-8-9-21-11-14/h4-9,11-13H,10H2,1-3H3,(H,18,19)
InChIKeyOBQMXHQEZZDCSO-UHFFFAOYSA-N
XLogP3.14
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-1-(furan-3-yl)propan-2-yl]-3-(4-methoxyphenyl)propanamide
CID 97030226
2-(4-methoxyphenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 94843836
2-(furan-3-yl)-1-(4-methoxyphenyl)ethanamine
CID 83175778
2-(4-methoxyphenyl)-N-propan-2-ylacetamide
CID 813075
2-bromo-N-[(1S)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81370298
N-[1-(furan-3-yl)propan-2-yl]-2,4-dimethoxybenzamide
CID 121127019
N-[1-(4-methoxyphenyl)ethyl]-3-(propan-2-ylamino)propanamide
CID 66195262
2-(4-methoxyphenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
CID 134060669
N-(furan-3-ylmethyl)-1-(4-methoxyphenyl)propan-2-amine
CID 115711421
N-[(1R)-1-(4-fluorophenyl)ethyl]-2-(4-methoxyphenyl)acetamide
CID 2713156
2-(4-methoxyphenyl)-N-(2-methyl-1-phenylpropyl)acetamide
CID 2964250
2-(4-methoxyphenyl)-N-[(1S)-2-methyl-1-phenylpropyl]acetamide
CID 974465

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide?
The IUPAC name of 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide (CID 126810206) is 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide.
What is the SMILES notation for 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide?
The canonical SMILES for 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide is COc1ccc(C(C)C(C)NC(=O)Cc2ccoc2)cc1.
What is the InChIKey of 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide?
The InChIKey is OBQMXHQEZZDCSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3/c1-12(15-4-6-16(20-3)7-5-15)13(2)18-17(19)10-14-8-9-21-11-14/h4-9,11-13H,10H2,1-3H3,(H,18,19).
What are the key properties of 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide?
2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide has a molecular weight of 287.36 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-N-[3-(4-methoxyphenyl)butan-2-yl]acetamide is sourced from PubChem (CID 126810206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).