1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea

C18H20N2O2 — CID 108907781

IUPAC1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea
SMILESCCc1ccccc1NC(=O)N/C=C/c1ccc(OC)cc1
InChIInChI=1S/C18H20N2O2/c1-3-15-6-4-5-7-17(15)20-18(21)19-13-12-14-8-10-16(22-2)11-9-14/h4-13H,3H2,1-2H3,(H2,19,20,21)/b13-12+
InChIKeyMVJUFJVALPCJHS-OUKQBFOZSA-N
MW296.37 g/mol
LogP4.05
Rot. Bonds5

About 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea

1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea (PubChem CID 108907781) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea.

Molecular Properties

Compound Name1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea
PubChem CID108907781
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea
SMILESCCc1ccccc1NC(=O)N/C=C/c1ccc(OC)cc1
InChIInChI=1S/C18H20N2O2/c1-3-15-6-4-5-7-17(15)20-18(21)19-13-12-14-8-10-16(22-2)11-9-14/h4-13H,3H2,1-2H3,(H2,19,20,21)/b13-12+
InChIKeyMVJUFJVALPCJHS-OUKQBFOZSA-N
XLogP4.05
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(E)-2-(4-methoxyphenyl)ethenyl]-3-pyrimidin-2-ylurea
CID 108907686
1-(2-methoxyphenyl)-3-[(E)-2-phenylethenyl]urea
CID 108903091
1-(2-ethylphenyl)-3-[(4-methoxyphenyl)methyl]urea
CID 17379696
N-[3-[[(E)-2-(4-methoxyphenyl)ethenyl]carbamoylamino]phenyl]acetamide
CID 108907739
1-[(E)-2-(4-methoxyphenyl)ethenyl]-3-[(4-methoxyphenyl)methyl]urea
CID 108907604
N-(2-ethylphenyl)-N'-[(4-methoxyphenyl)methylideneamino]oxamide
CID 3318922
1-(2-amino-5-methylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea
CID 108907850
1-[(4-methoxyphenyl)methyl]-3-[(E)-2-phenylethenyl]urea
CID 108903141
1,1-diethyl-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea
CID 108907733
1-(3,4-diethoxyphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea
CID 108907679
1-[(E)-2-(4-methoxyphenyl)ethenyl]-3-(pyridin-2-ylmethyl)urea
CID 108907670
1-(2-fluorophenyl)-3-[(E)-2-(3-methoxyphenyl)ethenyl]urea
CID 108905825

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea?
The IUPAC name of 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea (CID 108907781) is 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea.
What is the SMILES notation for 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea?
The canonical SMILES for 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea is CCc1ccccc1NC(=O)N/C=C/c1ccc(OC)cc1.
What is the InChIKey of 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea?
The InChIKey is MVJUFJVALPCJHS-OUKQBFOZSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-3-15-6-4-5-7-17(15)20-18(21)19-13-12-14-8-10-16(22-2)11-9-14/h4-13H,3H2,1-2H3,(H2,19,20,21)/b13-12+.
What are the key properties of 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea?
1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea has a molecular weight of 296.37 g/mol, XLogP of 4.05, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]urea is sourced from PubChem (CID 108907781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).