N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide

C20H24ClNO4 — CID 43905902

IUPACN-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide
SMILESCOc1cc(NC(=O)C(C)Oc2ccccc2C(C)C)c(OC)cc1Cl
InChIInChI=1S/C20H24ClNO4/c1-12(2)14-8-6-7-9-17(14)26-13(3)20(23)22-16-11-18(24-4)15(21)10-19(16)25-5/h6-13H,1-5H3,(H,22,23)
InChIKeyUCWZDIGTHWENSA-UHFFFAOYSA-N
MW377.87 g/mol
LogP4.89
Rot. Bonds7

About N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide

N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide (PubChem CID 43905902) has the molecular formula C20H24ClNO4 and a molecular weight of 377.87 g/mol. Its IUPAC name is N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound NameN-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide
PubChem CID43905902
Molecular FormulaC20H24ClNO4
Molecular Weight377.87 g/mol
Exact Mass377.14
IUPAC NameN-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide
SMILESCOc1cc(NC(=O)C(C)Oc2ccccc2C(C)C)c(OC)cc1Cl
InChIInChI=1S/C20H24ClNO4/c1-12(2)14-8-6-7-9-17(14)26-13(3)20(23)22-16-11-18(24-4)15(21)10-19(16)25-5/h6-13H,1-5H3,(H,22,23)
InChIKeyUCWZDIGTHWENSA-UHFFFAOYSA-N
XLogP4.89
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.87
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-methoxyphenoxy)propanamide
CID 9181052
2-(2-propan-2-ylphenoxy)-N-(2,4,5-trichlorophenyl)propanamide
CID 46769245
(2S)-N-(4-chloro-2,5-dimethoxyphenyl)-2-(2,3-dimethylphenoxy)propanamide
CID 38916474
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2,3-dimethylphenoxy)propanamide
CID 46771651
(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide
CID 31966341
N-(4-chloro-2,5-dimethoxyphenyl)-2-(3-methoxyphenoxy)propanamide
CID 19203937
(2S)-2-(2-propan-2-ylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 28636194
(2R)-2-(2-propan-2-ylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 28636193
N-(2-methoxy-5-nitrophenyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 43875640
N-(4-chloro-2,5-dimethoxyphenyl)-2-(4-methylphenoxy)propanamide
CID 42905073
(2R)-N-(5-chloro-2-phenoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 28569618
(2R)-N-(2-chlorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 42082100

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide?
The IUPAC name of N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide (CID 43905902) is N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide?
The canonical SMILES for N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide is COc1cc(NC(=O)C(C)Oc2ccccc2C(C)C)c(OC)cc1Cl.
What is the InChIKey of N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide?
The InChIKey is UCWZDIGTHWENSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClNO4/c1-12(2)14-8-6-7-9-17(14)26-13(3)20(23)22-16-11-18(24-4)15(21)10-19(16)25-5/h6-13H,1-5H3,(H,22,23).
What are the key properties of N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide?
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide has a molecular weight of 377.87 g/mol, XLogP of 4.89, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 43905902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).