N-[2,4-bis(prop-2-enyl)phenoxy]acetamide

C14H17NO2 — CID 141350333

IUPACN-[2,4-bis(prop-2-enyl)phenoxy]acetamide
SMILESC=CCc1ccc(ONC(C)=O)c(CC=C)c1
InChIInChI=1S/C14H17NO2/c1-4-6-12-8-9-14(17-15-11(3)16)13(10-12)7-5-2/h4-5,8-10H,1-2,6-7H2,3H3,(H,15,16)
InChIKeyJJQKUMTWZOSFBN-UHFFFAOYSA-N
MW231.29 g/mol
LogP2.57
Rot. Bonds6

About N-[2,4-bis(prop-2-enyl)phenoxy]acetamide

N-[2,4-bis(prop-2-enyl)phenoxy]acetamide (PubChem CID 141350333) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is N-[2,4-bis(prop-2-enyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-[2,4-bis(prop-2-enyl)phenoxy]acetamide
PubChem CID141350333
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC NameN-[2,4-bis(prop-2-enyl)phenoxy]acetamide
SMILESC=CCc1ccc(ONC(C)=O)c(CC=C)c1
InChIInChI=1S/C14H17NO2/c1-4-6-12-8-9-14(17-15-11(3)16)13(10-12)7-5-2/h4-5,8-10H,1-2,6-7H2,3H3,(H,15,16)
InChIKeyJJQKUMTWZOSFBN-UHFFFAOYSA-N
XLogP2.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl 2-[2-(2-methoxy-2-oxoethoxy)-4-prop-2-enylphenoxy]acetate
CID 67377849
[2-(4-methoxy-3-prop-2-enylphenyl)-4-prop-2-enylphenyl] acetate
CID 45269977
chloromethyl (2-methoxy-4-prop-2-enylphenyl) carbonate
CID 88995763
acetic acid;(2-methoxy-4-prop-2-enylphenyl) acetate
CID 159570421
2,4-bis(prop-2-enyl)aniline
CID 67154427
2-(2-methoxy-4-prop-2-enylphenoxy)acetohydrazide
CID 764178
1-(4-pentoxy-3-prop-2-enylphenyl)ethanone
CID 54849741
methyl 2-[2-(dimethylamino)-5-prop-2-enylphenyl]acetate
CID 58973642
methyl 6-prop-2-enylnaphthalene-2-carboxylate
CID 163936800
prop-2-enyl 2-[2-(chloromethyl)-5-prop-2-enylphenoxy]propanoate
CID 70316138
1-[4-methoxy-3,5-bis(prop-2-enyl)phenyl]ethanone
CID 54517444
methyl 4-prop-2-enoxy-3-prop-2-enylbenzoate
CID 11241748

Frequently Asked Questions

What is the IUPAC name of N-[2,4-bis(prop-2-enyl)phenoxy]acetamide?
The IUPAC name of N-[2,4-bis(prop-2-enyl)phenoxy]acetamide (CID 141350333) is N-[2,4-bis(prop-2-enyl)phenoxy]acetamide.
What is the SMILES notation for N-[2,4-bis(prop-2-enyl)phenoxy]acetamide?
The canonical SMILES for N-[2,4-bis(prop-2-enyl)phenoxy]acetamide is C=CCc1ccc(ONC(C)=O)c(CC=C)c1.
What is the InChIKey of N-[2,4-bis(prop-2-enyl)phenoxy]acetamide?
The InChIKey is JJQKUMTWZOSFBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-4-6-12-8-9-14(17-15-11(3)16)13(10-12)7-5-2/h4-5,8-10H,1-2,6-7H2,3H3,(H,15,16).
What are the key properties of N-[2,4-bis(prop-2-enyl)phenoxy]acetamide?
N-[2,4-bis(prop-2-enyl)phenoxy]acetamide has a molecular weight of 231.29 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,4-bis(prop-2-enyl)phenoxy]acetamide is sourced from PubChem (CID 141350333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).