2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide

C17H20N2O3 — CID 46995681

IUPAC2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
SMILESCNCC(=O)Nc1ccccc1OCCOc1ccccc1
InChIInChI=1S/C17H20N2O3/c1-18-13-17(20)19-15-9-5-6-10-16(15)22-12-11-21-14-7-3-2-4-8-14/h2-10,18H,11-13H2,1H3,(H,19,20)
InChIKeyRWCGBHCKTWDQJL-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.30
Rot. Bonds8

About 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide

2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide (PubChem CID 46995681) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
PubChem CID46995681
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
SMILESCNCC(=O)Nc1ccccc1OCCOc1ccccc1
InChIInChI=1S/C17H20N2O3/c1-18-13-17(20)19-15-9-5-6-10-16(15)22-12-11-21-14-7-3-2-4-8-14/h2-10,18H,11-13H2,1H3,(H,19,20)
InChIKeyRWCGBHCKTWDQJL-UHFFFAOYSA-N
XLogP2.30
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.30
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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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide?
The IUPAC name of 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide (CID 46995681) is 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide?
The canonical SMILES for 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide is CNCC(=O)Nc1ccccc1OCCOc1ccccc1.
What is the InChIKey of 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide?
The InChIKey is RWCGBHCKTWDQJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-18-13-17(20)19-15-9-5-6-10-16(15)22-12-11-21-14-7-3-2-4-8-14/h2-10,18H,11-13H2,1H3,(H,19,20).
What are the key properties of 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide?
2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide has a molecular weight of 300.36 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide is sourced from PubChem (CID 46995681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).