N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide

C16H15BrClNO2 — CID 7917215

IUPACN-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide
SMILESCCc1cc(OCC(=O)Nc2cccc(Br)c2)ccc1Cl
InChIInChI=1S/C16H15BrClNO2/c1-2-11-8-14(6-7-15(11)18)21-10-16(20)19-13-5-3-4-12(17)9-13/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyOQTLDKCBGHLINP-UHFFFAOYSA-N
MW368.66 g/mol
LogP4.68
Rot. Bonds5

About N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide

N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide (PubChem CID 7917215) has the molecular formula C16H15BrClNO2 and a molecular weight of 368.66 g/mol. Its IUPAC name is N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide
PubChem CID7917215
Molecular FormulaC16H15BrClNO2
Molecular Weight368.66 g/mol
Exact Mass367.00
IUPAC NameN-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide
SMILESCCc1cc(OCC(=O)Nc2cccc(Br)c2)ccc1Cl
InChIInChI=1S/C16H15BrClNO2/c1-2-11-8-14(6-7-15(11)18)21-10-16(20)19-13-5-3-4-12(17)9-13/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyOQTLDKCBGHLINP-UHFFFAOYSA-N
XLogP4.68
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.66
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide
CID 7642625
2-(4-bromophenoxy)-N-(3-bromophenyl)acetamide
CID 2631877
2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide
CID 7935227
N-(3-bromophenyl)-2-(3-hydroxyphenoxy)acetamide
CID 43143567
2-(4-chloro-3-ethylphenoxy)-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 16545130
N-(3-bromophenyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19178145
2-(4-chloro-3-ethylphenoxy)-N-(2-methylphenyl)acetamide
CID 18074792
2-[4-[(1R)-1-aminoethyl]phenoxy]-N-(3-bromophenyl)acetamide
CID 78933587
2-(2-bromo-4-ethylphenoxy)-N-(3-bromophenyl)acetamide
CID 19202087
2-(4-chloro-3-ethylphenoxy)-N-propan-2-ylacetamide
CID 84602074
2-(2-bromo-4-chlorophenoxy)-N-(3-bromophenyl)acetamide
CID 19202088
3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-methylbenzamide
CID 9196891

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide?
The IUPAC name of N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide (CID 7917215) is N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide.
What is the SMILES notation for N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide?
The canonical SMILES for N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide is CCc1cc(OCC(=O)Nc2cccc(Br)c2)ccc1Cl.
What is the InChIKey of N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide?
The InChIKey is OQTLDKCBGHLINP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrClNO2/c1-2-11-8-14(6-7-15(11)18)21-10-16(20)19-13-5-3-4-12(17)9-13/h3-9H,2,10H2,1H3,(H,19,20).
What are the key properties of N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide?
N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide has a molecular weight of 368.66 g/mol, XLogP of 4.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-2-(4-chloro-3-ethylphenoxy)acetamide is sourced from PubChem (CID 7917215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).