2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide

C18H27NO3 — CID 78766138

IUPAC2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide
SMILESCC=Cc1ccc(OCC(=O)N(C(C)C)C(C)C)c(OC)c1
InChIInChI=1S/C18H27NO3/c1-7-8-15-9-10-16(17(11-15)21-6)22-12-18(20)19(13(2)3)14(4)5/h7-11,13-14H,12H2,1-6H3
InChIKeyPXIPYPMVUWSPHZ-UHFFFAOYSA-N
MW305.42 g/mol
LogP3.75
Rot. Bonds7

About 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide

2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide (PubChem CID 78766138) has the molecular formula C18H27NO3 and a molecular weight of 305.42 g/mol. Its IUPAC name is 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide
PubChem CID78766138
Molecular FormulaC18H27NO3
Molecular Weight305.42 g/mol
Exact Mass305.20
IUPAC Name2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide
SMILESCC=Cc1ccc(OCC(=O)N(C(C)C)C(C)C)c(OC)c1
InChIInChI=1S/C18H27NO3/c1-7-8-15-9-10-16(17(11-15)21-6)22-12-18(20)19(13(2)3)14(4)5/h7-11,13-14H,12H2,1-6H3
InChIKeyPXIPYPMVUWSPHZ-UHFFFAOYSA-N
XLogP3.75
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
CID 78766081
1-(2-methoxy-4-prop-1-enylphenoxy)-3-methylbutan-2-one
CID 79395591
1-(2-methoxy-4-prop-1-enylphenoxy)butan-2-one
CID 76931733
N,N-bis(2-cyanoethyl)-2-(2-methoxy-4-prop-1-enylphenoxy)acetamide
CID 78767174
N-(1-hydroxypropan-2-yl)-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 78857545
N-(cyclopropylmethyl)-2-(2-methoxy-4-prop-1-enylphenoxy)-N-propylacetamide
CID 112786589
1-cyanoethyl 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate
CID 47004295
N-cyclopropyl-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7973430
2-(2-methoxy-4-prop-1-enylphenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 78766207
(4-ethoxyphenyl) 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate
CID 18284889
N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-N-methylacetamide
CID 9468770
[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate
CID 7907861

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide?
The IUPAC name of 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide (CID 78766138) is 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide.
What is the SMILES notation for 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide?
The canonical SMILES for 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide is CC=Cc1ccc(OCC(=O)N(C(C)C)C(C)C)c(OC)c1.
What is the InChIKey of 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide?
The InChIKey is PXIPYPMVUWSPHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO3/c1-7-8-15-9-10-16(17(11-15)21-6)22-12-18(20)19(13(2)3)14(4)5/h7-11,13-14H,12H2,1-6H3.
What are the key properties of 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide?
2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide has a molecular weight of 305.42 g/mol, XLogP of 3.75, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4-prop-1-enylphenoxy)-N,N-di(propan-2-yl)acetamide is sourced from PubChem (CID 78766138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).