2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide

C15H20N2O2 — CID 54814741

IUPAC2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)CNc1cccc(OC)c1
InChIInChI=1S/C15H20N2O2/c1-4-9-17(10-5-2)15(18)12-16-13-7-6-8-14(11-13)19-3/h4-8,11,16H,1-2,9-10,12H2,3H3
InChIKeyXSCREYAPCHWSOC-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.31
Rot. Bonds8

About 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide

2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide (PubChem CID 54814741) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide.

Molecular Properties

Compound Name2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide
PubChem CID54814741
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)CNc1cccc(OC)c1
InChIInChI=1S/C15H20N2O2/c1-4-9-17(10-5-2)15(18)12-16-13-7-6-8-14(11-13)19-3/h4-8,11,16H,1-2,9-10,12H2,3H3
InChIKeyXSCREYAPCHWSOC-UHFFFAOYSA-N
XLogP2.31
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-[bis(prop-2-enyl)amino]-2-oxoethyl]-[2-(3-methoxyanilino)-2-oxoethyl]-methylazanium
CID 8554899
(Z)-2-N-ethenyl-1-N-(3-methoxyphenyl)but-2-ene-1,2-diamine
CID 70305268
2-(3-methoxyanilino)-1-(4-methoxyphenyl)ethanone
CID 1133350
N-(3-methoxyphenyl)-2-[3-(2-methylprop-2-enoxy)anilino]acetamide
CID 54825899
ethyl 4-[2-(3-methoxyanilino)acetyl]piperazine-1-carboxylate
CID 109003882
(3-methoxyphenyl) but-3-enoate
CID 70109431
N-(3-methoxyphenyl)prop-2-enamide
CID 4069606
2-[(3-methoxyphenyl)carbamoyl-prop-2-enylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 42769233
2-(3-methoxyanilino)-N-(2-methoxyethyl)acetamide
CID 39335252
2-[2-(2-phenoxyethoxy)anilino]-N,N-bis(prop-2-enyl)acetamide
CID 54827057
methyl (E)-4-(3-methoxyanilino)but-2-enoate
CID 115032548
2-(3-acetamido-2-methylanilino)-N,N-bis(prop-2-enyl)acetamide
CID 32972903

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide?
The IUPAC name of 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide (CID 54814741) is 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide.
What is the SMILES notation for 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide?
The canonical SMILES for 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide is C=CCN(CC=C)C(=O)CNc1cccc(OC)c1.
What is the InChIKey of 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide?
The InChIKey is XSCREYAPCHWSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-9-17(10-5-2)15(18)12-16-13-7-6-8-14(11-13)19-3/h4-8,11,16H,1-2,9-10,12H2,3H3.
What are the key properties of 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide?
2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide has a molecular weight of 260.34 g/mol, XLogP of 2.31, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyanilino)-N,N-bis(prop-2-enyl)acetamide is sourced from PubChem (CID 54814741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).