2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide

C19H24N2O3 — CID 54829392

IUPAC2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide
SMILESCOCCOc1cccc(NCC(=O)NC(C)c2ccccc2)c1
InChIInChI=1S/C19H24N2O3/c1-15(16-7-4-3-5-8-16)21-19(22)14-20-17-9-6-10-18(13-17)24-12-11-23-2/h3-10,13,15,20H,11-12,14H2,1-2H3,(H,21,22)
InChIKeyPHAUTCRQEMETMP-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.00
Rot. Bonds9

About 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide

2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide (PubChem CID 54829392) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide
PubChem CID54829392
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide
SMILESCOCCOc1cccc(NCC(=O)NC(C)c2ccccc2)c1
InChIInChI=1S/C19H24N2O3/c1-15(16-7-4-3-5-8-16)21-19(22)14-20-17-9-6-10-18(13-17)24-12-11-23-2/h3-10,13,15,20H,11-12,14H2,1-2H3,(H,21,22)
InChIKeyPHAUTCRQEMETMP-UHFFFAOYSA-N
XLogP3.00
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(3-methoxyanilino)-N-(1-phenylethyl)acetamide
CID 54814569
4-[[2-[3-(2-phenoxyethoxy)anilino]acetyl]amino]-N-(1-phenylethyl)benzamide
CID 54825206
2-[3-(2-methoxyethoxy)anilino]-N-(3-methylbutan-2-yl)acetamide
CID 87029683
3-[[2-oxo-2-(1-phenylethylamino)ethyl]amino]-N-propan-2-ylbenzamide
CID 54833812
2-anilino-N-(1-phenylethyl)acetamide
CID 54810260
2-[3-(2-methoxyethoxy)anilino]-N-(2-propan-2-ylphenyl)acetamide
CID 54829653
2-(4-butoxyanilino)-N-(1-phenylethyl)acetamide
CID 54820323
N-(3,5-dimethylphenyl)-2-[3-(2-methoxyethoxy)anilino]acetamide
CID 54829779
N-ethyl-2-[3-(2-phenoxyethoxy)anilino]acetamide
CID 54826043
3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide
CID 4954951
N-[3-[[2-[3-(2-methoxyethoxy)anilino]acetyl]amino]phenyl]-3-phenylpropanamide
CID 54829756
N-[4-[[2-[3-(2-methoxyethoxy)anilino]acetyl]amino]phenyl]-3-phenylpropanamide
CID 54829431

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide (CID 54829392) is 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide is COCCOc1cccc(NCC(=O)NC(C)c2ccccc2)c1.
What is the InChIKey of 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide?
The InChIKey is PHAUTCRQEMETMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-15(16-7-4-3-5-8-16)21-19(22)14-20-17-9-6-10-18(13-17)24-12-11-23-2/h3-10,13,15,20H,11-12,14H2,1-2H3,(H,21,22).
What are the key properties of 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide?
2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide has a molecular weight of 328.41 g/mol, XLogP of 3.00, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methoxyethoxy)anilino]-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 54829392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).