N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide

C16H23NO3 — CID 78766081

IUPACN,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
SMILESCC=Cc1ccc(OCC(=O)N(CC)CC)c(OC)c1
InChIInChI=1S/C16H23NO3/c1-5-8-13-9-10-14(15(11-13)19-4)20-12-16(18)17(6-2)7-3/h5,8-11H,6-7,12H2,1-4H3
InChIKeyRPBKGXGYDGXYGA-UHFFFAOYSA-N
MW277.36 g/mol
LogP2.98
Rot. Bonds7

About N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide

N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide (PubChem CID 78766081) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
PubChem CID78766081
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC NameN,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
SMILESCC=Cc1ccc(OCC(=O)N(CC)CC)c(OC)c1
InChIInChI=1S/C16H23NO3/c1-5-8-13-9-10-14(15(11-13)19-4)20-12-16(18)17(6-2)7-3/h5,8-11H,6-7,12H2,1-4H3
InChIKeyRPBKGXGYDGXYGA-UHFFFAOYSA-N
XLogP2.98
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide
CID 78766138
N,N-bis(2-cyanoethyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
CID 78767174
1-(2-methoxy-4-prop-1-enylphenoxy)butan-2-one
CID 76931733
N-(cyclopropylmethyl)-2-(2-methoxy-4-prop-1-enylphenoxy)-N-propylacetamide
CID 112786589
N,N-diethyl-2-(2-methoxy-4-methylphenoxy)acetamide
CID 60626763
1-(2-methoxy-4-prop-1-enylphenoxy)-3-methylbutan-2-one
CID 79395591
N,N-diethyl-2-(4-ethyl-2-methoxyphenoxy)acetamide
CID 154118386
(4-ethoxyphenyl) 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate
CID 18284889
2-(4-carbamothioyl-2-methoxyphenoxy)-N,N-diethylacetamide
CID 24690581
ethyl 4-[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]piperazine-1-carboxylate
CID 36860916
2-(2-methoxy-4-prop-1-enylphenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 78766207
2-[4-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)-2-methoxyphenoxy]-N,N-diethylacetamide
CID 4778501

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide?
The IUPAC name of N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide (CID 78766081) is N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide.
What is the SMILES notation for N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide?
The canonical SMILES for N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide is CC=Cc1ccc(OCC(=O)N(CC)CC)c(OC)c1.
What is the InChIKey of N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide?
The InChIKey is RPBKGXGYDGXYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-5-8-13-9-10-14(15(11-13)19-4)20-12-16(18)17(6-2)7-3/h5,8-11H,6-7,12H2,1-4H3.
What are the key properties of N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide?
N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide has a molecular weight of 277.36 g/mol, XLogP of 2.98, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide is sourced from PubChem (CID 78766081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).