2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide

C18H21ClN2O3 — CID 119747202

IUPAC2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide
SMILESCCOCCOc1c(Cl)cccc1NC(=O)Cc1ccc(N)cc1
InChIInChI=1S/C18H21ClN2O3/c1-2-23-10-11-24-18-15(19)4-3-5-16(18)21-17(22)12-13-6-8-14(20)9-7-13/h3-9H,2,10-12,20H2,1H3,(H,21,22)
InChIKeyIUDHJUNMVFWPGB-UHFFFAOYSA-N
MW348.83 g/mol
LogP3.52
Rot. Bonds8

About 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide

2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide (PubChem CID 119747202) has the molecular formula C18H21ClN2O3 and a molecular weight of 348.83 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide
PubChem CID119747202
Molecular FormulaC18H21ClN2O3
Molecular Weight348.83 g/mol
Exact Mass348.12
IUPAC Name2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide
SMILESCCOCCOc1c(Cl)cccc1NC(=O)Cc1ccc(N)cc1
InChIInChI=1S/C18H21ClN2O3/c1-2-23-10-11-24-18-15(19)4-3-5-16(18)21-17(22)12-13-6-8-14(20)9-7-13/h3-9H,2,10-12,20H2,1H3,(H,21,22)
InChIKeyIUDHJUNMVFWPGB-UHFFFAOYSA-N
XLogP3.52
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.83
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-aminophenyl)-N-[3-chloro-2-(2-methoxyethoxy)phenyl]acetamide;hydrochloride
CID 86813908
3-amino-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]propanamide;hydrochloride
CID 119302410
2-(4-aminophenyl)-N-[5-chloro-2-(2-ethoxyethoxy)phenyl]acetamide
CID 119773164
(2S)-2-amino-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]propanamide;hydrochloride
CID 119302408
3-[3-chloro-2-(2-ethoxyethoxy)phenyl]-1,1-diethylurea
CID 56821996
2-[[3-chloro-2-(2-ethoxyethoxy)phenyl]carbamoyl]cyclobutane-1-carboxylic acid
CID 120975465
N-[3-chloro-2-(2-ethoxyethoxy)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119747231
N-(2,3-dichlorophenyl)-2-[4-(2-ethoxyethoxy)phenoxy]acetamide
CID 4732993
N-[2-(2-ethoxyethoxy)phenyl]-2-phenylacetamide
CID 17134061
2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide
CID 28711873
4-[[3-chloro-2-(2-ethoxyethoxy)phenyl]carbamoylamino]-4-methylpentanoic acid
CID 122078222
N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827691

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide?
The IUPAC name of 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide (CID 119747202) is 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide is CCOCCOc1c(Cl)cccc1NC(=O)Cc1ccc(N)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide?
The InChIKey is IUDHJUNMVFWPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O3/c1-2-23-10-11-24-18-15(19)4-3-5-16(18)21-17(22)12-13-6-8-14(20)9-7-13/h3-9H,2,10-12,20H2,1H3,(H,21,22).
What are the key properties of 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide?
2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide has a molecular weight of 348.83 g/mol, XLogP of 3.52, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-[3-chloro-2-(2-ethoxyethoxy)phenyl]acetamide is sourced from PubChem (CID 119747202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).