2-(2-amino-6-chlorophenoxy)-N-methylpropanamide

C10H13ClN2O2 — CID 107715753

IUPAC2-(2-amino-6-chlorophenoxy)-N-methylpropanamide
SMILESCNC(=O)C(C)Oc1c(N)cccc1Cl
InChIInChI=1S/C10H13ClN2O2/c1-6(10(14)13-2)15-9-7(11)4-3-5-8(9)12/h3-6H,12H2,1-2H3,(H,13,14)
InChIKeyNNALTGFNQZRARA-UHFFFAOYSA-N
MW228.68 g/mol
LogP1.44
Rot. Bonds3

About 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide

2-(2-amino-6-chlorophenoxy)-N-methylpropanamide (PubChem CID 107715753) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide.

Molecular Properties

Compound Name2-(2-amino-6-chlorophenoxy)-N-methylpropanamide
PubChem CID107715753
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Name2-(2-amino-6-chlorophenoxy)-N-methylpropanamide
SMILESCNC(=O)C(C)Oc1c(N)cccc1Cl
InChIInChI=1S/C10H13ClN2O2/c1-6(10(14)13-2)15-9-7(11)4-3-5-8(9)12/h3-6H,12H2,1-2H3,(H,13,14)
InChIKeyNNALTGFNQZRARA-UHFFFAOYSA-N
XLogP1.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-amino-6-fluorophenoxy)-N-methylpropanamide
CID 104831459
2-[2-(2-aminobutyl)-6-chlorophenoxy]-N-methylpropanamide
CID 112615730
2-(2-amino-6-chlorophenoxy)-N,N-dimethylpropanamide
CID 107715840
2-(2-amino-6-chlorophenoxy)-N-(3-methoxypropyl)propanamide
CID 107715953
2-(2-amino-6-chlorophenoxy)propanenitrile
CID 107715942
(2R)-2-(3-aminophenoxy)-N-methylpropanamide
CID 28908554
2-[2-(aminomethyl)-6-chlorophenoxy]-N-phenylpropanamide
CID 115951957
ethyl 2-(2,6-dichlorophenoxy)propanoate
CID 13177850
2-[2-chloro-6-(hydroxymethyl)phenoxy]-N-phenylpropanamide
CID 115956267
2-[2-(aminomethyl)-6-fluorophenoxy]-N-methylpropanamide
CID 112608112
2-[2-(aminomethyl)-6-chlorophenoxy]-N-prop-2-ynylpropanamide
CID 112607862
2-[2-(2-aminoethyl)-6-chlorophenoxy]-N-ethylpropanamide
CID 112615083

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide?
The IUPAC name of 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide (CID 107715753) is 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide.
What is the SMILES notation for 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide?
The canonical SMILES for 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide is CNC(=O)C(C)Oc1c(N)cccc1Cl.
What is the InChIKey of 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide?
The InChIKey is NNALTGFNQZRARA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c1-6(10(14)13-2)15-9-7(11)4-3-5-8(9)12/h3-6H,12H2,1-2H3,(H,13,14).
What are the key properties of 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide?
2-(2-amino-6-chlorophenoxy)-N-methylpropanamide has a molecular weight of 228.68 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-6-chlorophenoxy)-N-methylpropanamide is sourced from PubChem (CID 107715753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).