N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide

C16H25NO2 — CID 3050602

IUPACN-(2-butoxyethyl)-N-(2-phenylethyl)acetamide
SMILESCCCCOCCN(CCc1ccccc1)C(C)=O
InChIInChI=1S/C16H25NO2/c1-3-4-13-19-14-12-17(15(2)18)11-10-16-8-6-5-7-9-16/h5-9H,3-4,10-14H2,1-2H3
InChIKeyONCXMVWUBZMPLY-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.89
Rot. Bonds9

About N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide

N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide (PubChem CID 3050602) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound NameN-(2-butoxyethyl)-N-(2-phenylethyl)acetamide
PubChem CID3050602
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-(2-butoxyethyl)-N-(2-phenylethyl)acetamide
SMILESCCCCOCCN(CCc1ccccc1)C(C)=O
InChIInChI=1S/C16H25NO2/c1-3-4-13-19-14-12-17(15(2)18)11-10-16-8-6-5-7-9-16/h5-9H,3-4,10-14H2,1-2H3
InChIKeyONCXMVWUBZMPLY-UHFFFAOYSA-N
XLogP2.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide?
The IUPAC name of N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide (CID 3050602) is N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide?
The canonical SMILES for N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide is CCCCOCCN(CCc1ccccc1)C(C)=O.
What is the InChIKey of N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide?
The InChIKey is ONCXMVWUBZMPLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-3-4-13-19-14-12-17(15(2)18)11-10-16-8-6-5-7-9-16/h5-9H,3-4,10-14H2,1-2H3.
What are the key properties of N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide?
N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.89, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butoxyethyl)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 3050602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).