1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea

C17H20N2O2 — CID 108869177

IUPAC1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea
SMILESCCN(C(=O)Nc1cccc(OC)c1)c1cccc(C)c1
InChIInChI=1S/C17H20N2O2/c1-4-19(15-9-5-7-13(2)11-15)17(20)18-14-8-6-10-16(12-14)21-3/h5-12H,4H2,1-3H3,(H,18,20)
InChIKeyCTLVONXVKRDINM-UHFFFAOYSA-N
MW284.36 g/mol
LogP4.06
Rot. Bonds4

About 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea

1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea (PubChem CID 108869177) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea.

Molecular Properties

Compound Name1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea
PubChem CID108869177
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea
SMILESCCN(C(=O)Nc1cccc(OC)c1)c1cccc(C)c1
InChIInChI=1S/C17H20N2O2/c1-4-19(15-9-5-7-13(2)11-15)17(20)18-14-8-6-10-16(12-14)21-3/h5-12H,4H2,1-3H3,(H,18,20)
InChIKeyCTLVONXVKRDINM-UHFFFAOYSA-N
XLogP4.06
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-3-methylanilino)-N-(3-methoxyphenyl)acetamide
CID 113167583
3-(3,5-dihydroxyphenyl)-1-ethyl-1-(3-methylphenyl)urea
CID 108895597
3-(3,4-difluorophenyl)-1-ethyl-1-(3-methylphenyl)urea
CID 108992795
1-ethyl-3-[(E)-2-(3-methoxyphenyl)ethenyl]-1-(3-methylphenyl)urea
CID 108905972
3-(4-cyanophenyl)-1-ethyl-1-(3-methylphenyl)urea
CID 108992791
N-ethyl-N'-(4-methoxyphenyl)-2,2-dimethyl-N-(3-methylphenyl)propanediamide
CID 108969447
2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 109009943
2-(N-ethylanilino)-N-(3-methoxyphenyl)acetamide
CID 51159812
N-(3,4-dimethoxyphenyl)-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108956025
N'-ethyl-N'-(3-methylphenyl)-N-phenyloxamide
CID 108521844
1-ethyl-3-(3-methoxypropyl)-1-(3-methylphenyl)urea
CID 108988156
1-[3-[(3-methoxyphenyl)carbamoylamino]propyl]-3-(4-methylphenyl)-1-phenylurea
CID 42702260

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea?
The IUPAC name of 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea (CID 108869177) is 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea.
What is the SMILES notation for 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea?
The canonical SMILES for 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea is CCN(C(=O)Nc1cccc(OC)c1)c1cccc(C)c1.
What is the InChIKey of 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea?
The InChIKey is CTLVONXVKRDINM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-4-19(15-9-5-7-13(2)11-15)17(20)18-14-8-6-10-16(12-14)21-3/h5-12H,4H2,1-3H3,(H,18,20).
What are the key properties of 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea?
1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea has a molecular weight of 284.36 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(3-methoxyphenyl)-1-(3-methylphenyl)urea is sourced from PubChem (CID 108869177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).