2-(2-acetylphenoxy)-N,N-dipropylacetamide

C16H23NO3 — CID 82312013

IUPAC2-(2-acetylphenoxy)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)COc1ccccc1C(C)=O
InChIInChI=1S/C16H23NO3/c1-4-10-17(11-5-2)16(19)12-20-15-9-7-6-8-14(15)13(3)18/h6-9H,4-5,10-12H2,1-3H3
InChIKeyYSLONUAOVJPNJD-UHFFFAOYSA-N
MW277.36 g/mol
LogP2.92
Rot. Bonds8

About 2-(2-acetylphenoxy)-N,N-dipropylacetamide

2-(2-acetylphenoxy)-N,N-dipropylacetamide (PubChem CID 82312013) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is 2-(2-acetylphenoxy)-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-(2-acetylphenoxy)-N,N-dipropylacetamide
PubChem CID82312013
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Name2-(2-acetylphenoxy)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)COc1ccccc1C(C)=O
InChIInChI=1S/C16H23NO3/c1-4-10-17(11-5-2)16(19)12-20-15-9-7-6-8-14(15)13(3)18/h6-9H,4-5,10-12H2,1-3H3
InChIKeyYSLONUAOVJPNJD-UHFFFAOYSA-N
XLogP2.92
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-acetylphenoxy)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 112781553
N-(2-hydroxyethyl)-2-(2-methoxyphenoxy)-N-propylacetamide
CID 60655941
propyl 2-(2-acetylphenoxy)acetate
CID 82312019
2-[[2-(2-hydroxyphenoxy)acetyl]-propylamino]acetic acid
CID 54898573
2-(2-carbamothioylphenoxy)-N-(cyclopropylmethyl)-N-propylacetamide
CID 61442997
2-[2-(dipropylamino)-2-oxoethoxy]-5-methylbenzoic acid
CID 61379859
2-(2-acetylphenoxy)-N-benzhydryl-N-methylacetamide
CID 112781539
sodium 2-(2-acetylphenoxy)acetate
CID 23600043
2-[[2-(2-bromophenoxy)acetyl]-propylamino]acetic acid
CID 120519580
2-[3-[2-(dipropylamino)-2-oxoethoxy]phenoxy]-N,N-dipropylacetamide
CID 71326234
ethyl N-[2-(2-acetylphenoxy)acetyl]carbamate
CID 7859274
2-(2-ethoxyphenoxy)-N,N-diethylacetamide
CID 60625239

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetylphenoxy)-N,N-dipropylacetamide?
The IUPAC name of 2-(2-acetylphenoxy)-N,N-dipropylacetamide (CID 82312013) is 2-(2-acetylphenoxy)-N,N-dipropylacetamide.
What is the SMILES notation for 2-(2-acetylphenoxy)-N,N-dipropylacetamide?
The canonical SMILES for 2-(2-acetylphenoxy)-N,N-dipropylacetamide is CCCN(CCC)C(=O)COc1ccccc1C(C)=O.
What is the InChIKey of 2-(2-acetylphenoxy)-N,N-dipropylacetamide?
The InChIKey is YSLONUAOVJPNJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-4-10-17(11-5-2)16(19)12-20-15-9-7-6-8-14(15)13(3)18/h6-9H,4-5,10-12H2,1-3H3.
What are the key properties of 2-(2-acetylphenoxy)-N,N-dipropylacetamide?
2-(2-acetylphenoxy)-N,N-dipropylacetamide has a molecular weight of 277.36 g/mol, XLogP of 2.92, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylphenoxy)-N,N-dipropylacetamide is sourced from PubChem (CID 82312013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).