2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide

C18H19BrClNO2 — CID 19202395

IUPAC2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide
SMILESCCCc1ccc(OCC(=O)Nc2cc(Cl)ccc2C)c(Br)c1
InChIInChI=1S/C18H19BrClNO2/c1-3-4-13-6-8-17(15(19)9-13)23-11-18(22)21-16-10-14(20)7-5-12(16)2/h5-10H,3-4,11H2,1-2H3,(H,21,22)
InChIKeyKEICKCGMSQBRKA-UHFFFAOYSA-N
MW396.71 g/mol
LogP5.38
Rot. Bonds6

About 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide

2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide (PubChem CID 19202395) has the molecular formula C18H19BrClNO2 and a molecular weight of 396.71 g/mol. Its IUPAC name is 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide
PubChem CID19202395
Molecular FormulaC18H19BrClNO2
Molecular Weight396.71 g/mol
Exact Mass395.03
IUPAC Name2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide
SMILESCCCc1ccc(OCC(=O)Nc2cc(Cl)ccc2C)c(Br)c1
InChIInChI=1S/C18H19BrClNO2/c1-3-4-13-6-8-17(15(19)9-13)23-11-18(22)21-16-10-14(20)7-5-12(16)2/h5-10H,3-4,11H2,1-2H3,(H,21,22)
InChIKeyKEICKCGMSQBRKA-UHFFFAOYSA-N
XLogP5.38
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.71
LogP ≤ 55.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-benzoyl-4-chlorophenyl)-2-(2-bromo-4-propylphenoxy)acetamide
CID 19202630
2-[2-bromo-4-[(5-chloro-2-methylanilino)methyl]phenoxy]-N-(2,4-dimethylphenyl)acetamide
CID 126380816
2-[[2-(2-bromo-4-propylphenoxy)acetyl]amino]benzoic acid
CID 53264106
N-(4-chloro-2-methylphenyl)-2-(2,4-dibromophenoxy)acetamide
CID 1189036
2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide
CID 19202393
N-(2-bromo-4-nitrophenyl)-2-(2-bromo-4-propylphenoxy)acetamide
CID 19202464
2-(4-bromo-2,5-dimethylphenoxy)-N-(5-chloro-2-methoxyphenyl)acetamide
CID 5183208
N-(5-chloro-2-methylphenyl)-2-(2-hydroxyphenoxy)acetamide
CID 78770477
2-(2-bromo-4-propylphenoxy)-N-(2-phenylethyl)acetamide
CID 19201978
2-(2-bromo-4,6-dimethylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide
CID 5169100
2-(2-bromo-4-propylphenoxy)-N-(4-butoxyphenyl)acetamide
CID 19201701
2-(2-bromo-4-chlorophenoxy)-N-pentylacetamide
CID 19201316

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide?
The IUPAC name of 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide (CID 19202395) is 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide is CCCc1ccc(OCC(=O)Nc2cc(Cl)ccc2C)c(Br)c1.
What is the InChIKey of 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide?
The InChIKey is KEICKCGMSQBRKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19BrClNO2/c1-3-4-13-6-8-17(15(19)9-13)23-11-18(22)21-16-10-14(20)7-5-12(16)2/h5-10H,3-4,11H2,1-2H3,(H,21,22).
What are the key properties of 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide?
2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide has a molecular weight of 396.71 g/mol, XLogP of 5.38, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-propylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide is sourced from PubChem (CID 19202395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).