2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide

C11H14ClNO3 — CID 51279285

IUPAC2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide
SMILESCONC(=O)C(C)(C)Oc1ccc(Cl)cc1
InChIInChI=1S/C11H14ClNO3/c1-11(2,10(14)13-15-3)16-9-6-4-8(12)5-7-9/h4-7H,1-3H3,(H,13,14)
InChIKeyLAQMJOVDPCBQIP-UHFFFAOYSA-N
MW243.69 g/mol
LogP2.17
Rot. Bonds4

About 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide

2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide (PubChem CID 51279285) has the molecular formula C11H14ClNO3 and a molecular weight of 243.69 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide
PubChem CID51279285
Molecular FormulaC11H14ClNO3
Molecular Weight243.69 g/mol
Exact Mass243.07
IUPAC Name2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide
SMILESCONC(=O)C(C)(C)Oc1ccc(Cl)cc1
InChIInChI=1S/C11H14ClNO3/c1-11(2,10(14)13-15-3)16-9-6-4-8(12)5-7-9/h4-7H,1-3H3,(H,13,14)
InChIKeyLAQMJOVDPCBQIP-UHFFFAOYSA-N
XLogP2.17
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.69
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(4-chlorophenoxy)-2-methylpropanoate
CID 6918953
4-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]benzamide
CID 888392
2-(4-chlorophenoxy)-N-(3,5-dimethoxyphenyl)-2-methylpropanamide
CID 848261
2-(4-chlorophenoxy)-N-[(4-chlorophenyl)methyl]-2-methylpropanamide
CID 2597715
2-(4-chlorophenoxy)-2-methyl-N-(2-methylphenyl)propanamide
CID 2184934
2-(4-chlorophenoxy)-2-methyl-N-(6-methyl-2-pyridinyl)propanamide
CID 800401
CID 131878857
CID 131878857
2-(4-chlorophenoxy)-N-(4-ethylphenyl)-2-methylpropanamide
CID 887329
N-(5-amino-2-methoxyphenyl)-2-(4-chlorophenoxy)-2-methylpropanamide
CID 50878617
3-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]propanoic acid
CID 43092383
4-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-N-methylbenzamide
CID 2679907
2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide
CID 3657024

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide (CID 51279285) is 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide is CONC(=O)C(C)(C)Oc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide?
The InChIKey is LAQMJOVDPCBQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO3/c1-11(2,10(14)13-15-3)16-9-6-4-8(12)5-7-9/h4-7H,1-3H3,(H,13,14).
What are the key properties of 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide?
2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide has a molecular weight of 243.69 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-methoxy-2-methylpropanamide is sourced from PubChem (CID 51279285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).