N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide

C16H17ClN2O2 — CID 28866983

IUPACN-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(CC(=O)Nc2ccc(Cl)c(N)c2)cc1
InChIInChI=1S/C16H17ClN2O2/c1-2-21-13-6-3-11(4-7-13)9-16(20)19-12-5-8-14(17)15(18)10-12/h3-8,10H,2,9,18H2,1H3,(H,19,20)
InChIKeyKGICZNCRKVCMLX-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.50
Rot. Bonds5

About N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide

N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide (PubChem CID 28866983) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide
PubChem CID28866983
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(CC(=O)Nc2ccc(Cl)c(N)c2)cc1
InChIInChI=1S/C16H17ClN2O2/c1-2-21-13-6-3-11(4-7-13)9-16(20)19-12-5-8-14(17)15(18)10-12/h3-8,10H,2,9,18H2,1H3,(H,19,20)
InChIKeyKGICZNCRKVCMLX-UHFFFAOYSA-N
XLogP3.50
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide
CID 18071163
N-(3-chloro-4-methoxyphenyl)-2-(4-ethoxyphenyl)acetamide
CID 26823011
N-(3,4-dichlorophenyl)-3-(4-ethoxyphenyl)propanamide
CID 19226004
N-(2-amino-5-chlorophenyl)-2-(4-ethoxyphenyl)acetamide;hydrate
CID 21154135
N-(3-amino-4-methoxyphenyl)-3-(4-ethoxyphenyl)propanamide
CID 119419441
N-(3-amino-4-chlorophenyl)-2-(4-fluorophenoxy)acetamide
CID 16788443
2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide
CID 2268503
N-(4-ethoxyphenyl)-2-(4-fluorophenyl)acetamide
CID 2289388
N-(4-bromophenyl)-2-(4-ethoxyphenyl)acetamide
CID 8719858
N-[4-chloro-3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-2-(4-ethoxyphenyl)acetamide
CID 7483313
2-(4-ethoxyphenyl)-N-(3-fluorophenyl)acetamide
CID 26579486
N-(3-amino-4-chlorophenyl)-3-(4-fluorophenoxy)propanamide
CID 29046897

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide?
The IUPAC name of N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide (CID 28866983) is N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide.
What is the SMILES notation for N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide?
The canonical SMILES for N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide is CCOc1ccc(CC(=O)Nc2ccc(Cl)c(N)c2)cc1.
What is the InChIKey of N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide?
The InChIKey is KGICZNCRKVCMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-2-21-13-6-3-11(4-7-13)9-16(20)19-12-5-8-14(17)15(18)10-12/h3-8,10H,2,9,18H2,1H3,(H,19,20).
What are the key properties of N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide?
N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide has a molecular weight of 304.78 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide is sourced from PubChem (CID 28866983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).