N,N-dibutyl-2-phenoxyacetamide

C16H25NO2 — CID 4074500

IUPACN,N-dibutyl-2-phenoxyacetamide
SMILESCCCCN(CCCC)C(=O)COc1ccccc1
InChIInChI=1S/C16H25NO2/c1-3-5-12-17(13-6-4-2)16(18)14-19-15-10-8-7-9-11-15/h7-11H,3-6,12-14H2,1-2H3
InChIKeyIWINMGFHTUPUQV-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.49
Rot. Bonds9

About N,N-dibutyl-2-phenoxyacetamide

N,N-dibutyl-2-phenoxyacetamide (PubChem CID 4074500) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N,N-dibutyl-2-phenoxyacetamide.

Molecular Properties

Compound NameN,N-dibutyl-2-phenoxyacetamide
PubChem CID4074500
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN,N-dibutyl-2-phenoxyacetamide
SMILESCCCCN(CCCC)C(=O)COc1ccccc1
InChIInChI=1S/C16H25NO2/c1-3-5-12-17(13-6-4-2)16(18)14-19-15-10-8-7-9-11-15/h7-11H,3-6,12-14H2,1-2H3
InChIKeyIWINMGFHTUPUQV-UHFFFAOYSA-N
XLogP3.49
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 ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-aminobutyl)-N-ethyl-2-phenoxyacetamide
CID 83969246
2-[3-[2-(dipropylamino)-2-oxoethoxy]phenoxy]-N,N-dipropylacetamide
CID 71326234
3-[ethyl-(2-phenoxyacetyl)amino]propanoic acid
CID 61007797
2-phenoxy-N-propyl-N-(trifluoromethyl)acetamide
CID 118436972
2-(3-acetylphenoxy)-N-butyl-N-ethylacetamide
CID 78785120
2-[carboxymethyl-(2-phenoxyacetyl)amino]acetic acid
CID 63651467
3-[2-hydroxyethyl-(2-phenoxyacetyl)amino]propanoic acid
CID 82325255
butyl-(2-hydroxy-3-phenoxypropyl)carbamic acid
CID 173251132
N-butyl-2-(4-iodophenoxy)-N-(2,2,2-trifluoroethyl)acetamide
CID 55763631
N-(3-aminopropyl)-N-benzyl-2-phenoxyacetamide;hydrochloride
CID 120649017
N-butyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide
CID 665147
3-[carboxymethyl-(2-phenoxyacetyl)amino]propanoic acid
CID 82325257

Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-2-phenoxyacetamide?
The IUPAC name of N,N-dibutyl-2-phenoxyacetamide (CID 4074500) is N,N-dibutyl-2-phenoxyacetamide.
What is the SMILES notation for N,N-dibutyl-2-phenoxyacetamide?
The canonical SMILES for N,N-dibutyl-2-phenoxyacetamide is CCCCN(CCCC)C(=O)COc1ccccc1.
What is the InChIKey of N,N-dibutyl-2-phenoxyacetamide?
The InChIKey is IWINMGFHTUPUQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-3-5-12-17(13-6-4-2)16(18)14-19-15-10-8-7-9-11-15/h7-11H,3-6,12-14H2,1-2H3.
What are the key properties of N,N-dibutyl-2-phenoxyacetamide?
N,N-dibutyl-2-phenoxyacetamide has a molecular weight of 263.38 g/mol, XLogP of 3.49, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-2-phenoxyacetamide is sourced from PubChem (CID 4074500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).