2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide

C17H18BrNO3 — CID 17096693

IUPAC2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)COc2ccc(Br)cc2)c1
InChIInChI=1S/C17H18BrNO3/c1-2-10-21-16-5-3-4-14(11-16)19-17(20)12-22-15-8-6-13(18)7-9-15/h3-9,11H,2,10,12H2,1H3,(H,19,20)
InChIKeyQSAWJVVEHGQBLN-UHFFFAOYSA-N
MW364.24 g/mol
LogP4.26
Rot. Bonds7

About 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide

2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide (PubChem CID 17096693) has the molecular formula C17H18BrNO3 and a molecular weight of 364.24 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide
PubChem CID17096693
Molecular FormulaC17H18BrNO3
Molecular Weight364.24 g/mol
Exact Mass363.05
IUPAC Name2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)COc2ccc(Br)cc2)c1
InChIInChI=1S/C17H18BrNO3/c1-2-10-21-16-5-3-4-14(11-16)19-17(20)12-22-15-8-6-13(18)7-9-15/h3-9,11H,2,10,12H2,1H3,(H,19,20)
InChIKeyQSAWJVVEHGQBLN-UHFFFAOYSA-N
XLogP4.26
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.24
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-(4-bromophenoxy)acetamide
CID 55901957
2-(4-bromo-2-methylphenoxy)-N-(3-propoxyphenyl)acetamide
CID 17096701
N-[3-[[2-(4-bromophenoxy)acetyl]amino]phenyl]butanamide
CID 1371979
2-(4-bromophenoxy)-N-(3-propan-2-yloxyphenyl)acetamide
CID 17154695
N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide
CID 78783405
2-(4-bromophenoxy)-N-(3-butan-2-yloxyphenyl)acetamide
CID 17161566
2-(4-bromophenoxy)-N-(3-bromophenyl)acetamide
CID 2631877
2-(4-bromo-3-methylphenoxy)-N-(3-butoxyphenyl)acetamide
CID 17095041
ethyl N-[3-[2-(4-bromoanilino)-2-oxoethoxy]phenyl]carbamate
CID 35775899
2-(3-bromophenoxy)-N-(3,4-dipropoxyphenyl)acetamide
CID 4843107
N'-[(Z)-[3-[2-(4-bromoanilino)-2-oxoethoxy]phenyl]methylideneamino]-N-(4-propoxyphenyl)oxamide
CID 126164295
2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide
CID 19628723

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide (CID 17096693) is 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide is CCCOc1cccc(NC(=O)COc2ccc(Br)cc2)c1.
What is the InChIKey of 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide?
The InChIKey is QSAWJVVEHGQBLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18BrNO3/c1-2-10-21-16-5-3-4-14(11-16)19-17(20)12-22-15-8-6-13(18)7-9-15/h3-9,11H,2,10,12H2,1H3,(H,19,20).
What are the key properties of 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide?
2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide has a molecular weight of 364.24 g/mol, XLogP of 4.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide is sourced from PubChem (CID 17096693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).