2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide

C15H14Cl2N2O2 — CID 18163135

IUPAC2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide
SMILESCC(NC(=O)COc1cc(Cl)ccc1Cl)c1cccnc1
InChIInChI=1S/C15H14Cl2N2O2/c1-10(11-3-2-6-18-8-11)19-15(20)9-21-14-7-12(16)4-5-13(14)17/h2-8,10H,9H2,1H3,(H,19,20)
InChIKeyDJLJEIONLJBCNT-UHFFFAOYSA-N
MW325.20 g/mol
LogP3.64
Rot. Bonds5

About 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide

2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide (PubChem CID 18163135) has the molecular formula C15H14Cl2N2O2 and a molecular weight of 325.20 g/mol. Its IUPAC name is 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide
PubChem CID18163135
Molecular FormulaC15H14Cl2N2O2
Molecular Weight325.20 g/mol
Exact Mass324.04
IUPAC Name2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide
SMILESCC(NC(=O)COc1cc(Cl)ccc1Cl)c1cccnc1
InChIInChI=1S/C15H14Cl2N2O2/c1-10(11-3-2-6-18-8-11)19-15(20)9-21-14-7-12(16)4-5-13(14)17/h2-8,10H,9H2,1H3,(H,19,20)
InChIKeyDJLJEIONLJBCNT-UHFFFAOYSA-N
XLogP3.64
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.20
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chloronaphthalen-1-yl)oxy-N-(1-pyridin-3-ylethyl)acetamide
CID 17404543
2,5-dichloro-N-(1-pyridin-3-ylethyl)benzamide
CID 18168780
2-(2,5-dichlorophenoxy)-N-[(1R)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]acetamide
CID 94820566
2-[2-(aminomethyl)phenoxy]-N-(1-pyridin-3-ylethyl)acetamide
CID 43523594
4-(2-chlorophenoxy)-N-(1-pyridin-3-ylethyl)butanamide
CID 49372898
4-(2-chlorophenoxy)-N-[(1S)-1-pyridin-3-ylethyl]butanamide
CID 94359742
2,4-dichloro-N-[2-oxo-2-(1-pyridin-3-ylethylamino)ethyl]benzamide
CID 51193025
N-[(1S)-1-(3-chlorophenyl)ethyl]-2-(2,4,5-trichlorophenoxy)acetamide
CID 7832863
2-(2,5-dichlorophenoxy)-N-(2-pyridin-3-ylethyl)acetamide
CID 24672717
2-(4-chloro-2-methylphenoxy)-N-[(1S)-1-pyridin-4-ylethyl]acetamide
CID 40585331
N-[1-(5-chlorothiophen-2-yl)ethyl]-2-(2,5-dichlorophenoxy)acetamide
CID 46419385
2-[2-oxo-2-(1-pyridin-3-ylethylamino)ethoxy]acetic acid
CID 61328794

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide?
The IUPAC name of 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide (CID 18163135) is 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide.
What is the SMILES notation for 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide?
The canonical SMILES for 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide is CC(NC(=O)COc1cc(Cl)ccc1Cl)c1cccnc1.
What is the InChIKey of 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide?
The InChIKey is DJLJEIONLJBCNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O2/c1-10(11-3-2-6-18-8-11)19-15(20)9-21-14-7-12(16)4-5-13(14)17/h2-8,10H,9H2,1H3,(H,19,20).
What are the key properties of 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide?
2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide has a molecular weight of 325.20 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenoxy)-N-(1-pyridin-3-ylethyl)acetamide is sourced from PubChem (CID 18163135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).