2-(3-chlorophenoxy)propanamide

C9H10ClNO2 — CID 22078

IUPAC2-(3-chlorophenoxy)propanamide
SMILESCC(Oc1cccc(Cl)c1)C(N)=O
InChIInChI=1S/C9H10ClNO2/c1-6(9(11)12)13-8-4-2-3-7(10)5-8/h2-6H,1H3,(H2,11,12)
InChIKeyQVTINYNCTADMES-UHFFFAOYSA-N
MW199.64 g/mol
LogP1.59
Rot. Bonds3

About 2-(3-chlorophenoxy)propanamide

2-(3-chlorophenoxy)propanamide (PubChem CID 22078) has the molecular formula C9H10ClNO2 and a molecular weight of 199.64 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)propanamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)propanamide
PubChem CID22078
Molecular FormulaC9H10ClNO2
Molecular Weight199.64 g/mol
Exact Mass199.04
IUPAC Name2-(3-chlorophenoxy)propanamide
SMILESCC(Oc1cccc(Cl)c1)C(N)=O
InChIInChI=1S/C9H10ClNO2/c1-6(9(11)12)13-8-4-2-3-7(10)5-8/h2-6H,1H3,(H2,11,12)
InChIKeyQVTINYNCTADMES-UHFFFAOYSA-N
XLogP1.59
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Phenoxyacetamide
CID 69314
2-(3-Chlorophenoxy)propanehydrazide
CID 2832641
Acetic acid, (4-chlorophenoxy)-, hydrazide
CID 774289
2-(2,4-Dichlorophenoxy)acetamide
CID 74798
2-(4-Methoxyphenoxy)acetamide
CID 723234
Acetamide, 2-(4-chlorophenoxy)-N-hydroxy-
CID 11183280
2-(4-Chloro-3-methylphenoxy)acetamide
CID 244052
2-(2-Chlorophenoxy)acetohydrazide
CID 181471
2-(2-Chlorophenoxy)acetamide
CID 97329
Methyl 2-[(4-chlorophenoxy)acetyl]hydrazinecarboxylate
CID 1787926
2-(3,4-dichlorophenoxy)-N-hydroxyacetamide
CID 145984790
2-(4-Chloro-2-methylphenoxy)acetamide
CID 81888

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)propanamide?
The IUPAC name of 2-(3-chlorophenoxy)propanamide (CID 22078) is 2-(3-chlorophenoxy)propanamide.
What is the SMILES notation for 2-(3-chlorophenoxy)propanamide?
The canonical SMILES for 2-(3-chlorophenoxy)propanamide is CC(Oc1cccc(Cl)c1)C(N)=O.
What is the InChIKey of 2-(3-chlorophenoxy)propanamide?
The InChIKey is QVTINYNCTADMES-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO2/c1-6(9(11)12)13-8-4-2-3-7(10)5-8/h2-6H,1H3,(H2,11,12).
What are the key properties of 2-(3-chlorophenoxy)propanamide?
2-(3-chlorophenoxy)propanamide has a molecular weight of 199.64 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)propanamide is sourced from PubChem (CID 22078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).