2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide

C15H16ClNO3 — CID 51187818

IUPAC2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide
SMILESCc1ccc(C(C)NC(=O)COc2ccccc2Cl)o1
InChIInChI=1S/C15H16ClNO3/c1-10-7-8-13(20-10)11(2)17-15(18)9-19-14-6-4-3-5-12(14)16/h3-8,11H,9H2,1-2H3,(H,17,18)
InChIKeyXYOFGPWXNCZXBU-UHFFFAOYSA-N
MW293.75 g/mol
LogP3.50
Rot. Bonds5

About 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide

2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide (PubChem CID 51187818) has the molecular formula C15H16ClNO3 and a molecular weight of 293.75 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide
PubChem CID51187818
Molecular FormulaC15H16ClNO3
Molecular Weight293.75 g/mol
Exact Mass293.08
IUPAC Name2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide
SMILESCc1ccc(C(C)NC(=O)COc2ccccc2Cl)o1
InChIInChI=1S/C15H16ClNO3/c1-10-7-8-13(20-10)11(2)17-15(18)9-19-14-6-4-3-5-12(14)16/h3-8,11H,9H2,1-2H3,(H,17,18)
InChIKeyXYOFGPWXNCZXBU-UHFFFAOYSA-N
XLogP3.50
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.75
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyphenoxy)-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]acetamide
CID 31001904
2-(2-chlorophenoxy)-N-[(1R)-1-(furan-2-yl)ethyl]acetamide
CID 9011821
2-(2-chlorophenoxy)-N-(1-phenylethyl)acetamide
CID 2787215
N-[1-(5-methylfuran-2-yl)ethyl]-2-naphthalen-2-yloxyacetamide
CID 51187811
N'-[2-(2-chlorophenoxy)acetyl]-5-methylfuran-2-carbohydrazide
CID 17467699
2-(2-chlorophenoxy)-N-[1-(2,4-dimethylphenyl)ethyl]acetamide
CID 17327655
2-(2-chlorophenoxy)-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]acetamide
CID 26834691
N-[1-(4-tert-butylphenyl)ethyl]-2-(2-chlorophenoxy)acetamide
CID 132652703
N-[(1R)-1-(3-bromophenyl)ethyl]-2-(2-chlorophenoxy)acetamide
CID 28555896
(2S)-2-[[2-(2-chlorophenoxy)acetyl]amino]-3-methylpentanoic acid
CID 61173622
3-chloro-N-[1-(5-methylfuran-2-yl)ethyl]propanamide
CID 43697661
N-(1-amino-4-methylpentan-2-yl)-2-(2-chlorophenoxy)acetamide
CID 119587183

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide (CID 51187818) is 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide is Cc1ccc(C(C)NC(=O)COc2ccccc2Cl)o1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide?
The InChIKey is XYOFGPWXNCZXBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO3/c1-10-7-8-13(20-10)11(2)17-15(18)9-19-14-6-4-3-5-12(14)16/h3-8,11H,9H2,1-2H3,(H,17,18).
What are the key properties of 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide?
2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide has a molecular weight of 293.75 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide is sourced from PubChem (CID 51187818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).