2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide

C15H15Cl2NO3 — CID 121127061

IUPAC2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide
SMILESCC(Cc1ccoc1)NC(=O)COc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H15Cl2NO3/c1-10(6-11-4-5-20-8-11)18-15(19)9-21-14-3-2-12(16)7-13(14)17/h2-5,7-8,10H,6,9H2,1H3,(H,18,19)
InChIKeyKKERQKICUHDMEA-UHFFFAOYSA-N
MW328.20 g/mol
LogP3.71
Rot. Bonds6

About 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide

2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide (PubChem CID 121127061) has the molecular formula C15H15Cl2NO3 and a molecular weight of 328.20 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide
PubChem CID121127061
Molecular FormulaC15H15Cl2NO3
Molecular Weight328.20 g/mol
Exact Mass327.04
IUPAC Name2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide
SMILESCC(Cc1ccoc1)NC(=O)COc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H15Cl2NO3/c1-10(6-11-4-5-20-8-11)18-15(19)9-21-14-3-2-12(16)7-13(14)17/h2-5,7-8,10H,6,9H2,1H3,(H,18,19)
InChIKeyKKERQKICUHDMEA-UHFFFAOYSA-N
XLogP3.71
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.20
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dichlorophenoxy)-N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 39086752
N-[(2S)-1-aminopropan-2-yl]-2-(2,4-dichlorophenoxy)acetamide
CID 120508613
2-(2,4-dichlorophenoxy)-N-[(2S)-1-methoxypropan-2-yl]acetamide
CID 2095997
2-(2,4-dichlorophenoxy)-N-[(2S)-3-methylbutan-2-yl]acetamide
CID 94223668
2-(2,4-dichlorophenoxy)-N-[1-(4-methoxyphenoxy)propan-2-yl]acetamide
CID 132657832
[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] 2-(2,4-dichlorophenoxy)acetate
CID 2621932
N-[(1R)-1-(2-chlorophenyl)ethyl]-2-(2,4-dichlorophenoxy)acetamide
CID 7859030
N-[cyano(propan-2-yloxy)methyl]-2-(2,4-dichlorophenoxy)acetamide
CID 139932008
2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-hydroxypropanoic acid
CID 595733
2-(2-acetyl-4-chlorophenoxy)-N-[(2R)-butan-2-yl]acetamide
CID 7167702
2-(2,4-dichlorophenoxy)-N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 94050777
(2R)-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-phenylpropanoate
CID 6961899

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide (CID 121127061) is 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide is CC(Cc1ccoc1)NC(=O)COc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide?
The InChIKey is KKERQKICUHDMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO3/c1-10(6-11-4-5-20-8-11)18-15(19)9-21-14-3-2-12(16)7-13(14)17/h2-5,7-8,10H,6,9H2,1H3,(H,18,19).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide?
2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide has a molecular weight of 328.20 g/mol, XLogP of 3.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-[1-(furan-3-yl)propan-2-yl]acetamide is sourced from PubChem (CID 121127061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).