1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea

C16H18N2O2 — CID 6469067

IUPAC1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea
SMILESCOc1cccc(NC(=O)Nc2ccc(C)cc2C)c1
InChIInChI=1S/C16H18N2O2/c1-11-7-8-15(12(2)9-11)18-16(19)17-13-5-4-6-14(10-13)20-3/h4-10H,1-3H3,(H2,17,18,19)
InChIKeyAXJZHHALHMKXDO-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.96
Rot. Bonds3

About 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea

1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea (PubChem CID 6469067) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea
PubChem CID6469067
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea
SMILESCOc1cccc(NC(=O)Nc2ccc(C)cc2C)c1
InChIInChI=1S/C16H18N2O2/c1-11-7-8-15(12(2)9-11)18-16(19)17-13-5-4-6-14(10-13)20-3/h4-10H,1-3H3,(H2,17,18,19)
InChIKeyAXJZHHALHMKXDO-UHFFFAOYSA-N
XLogP3.96
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxy-2-methylphenyl)-3-(3-methylphenyl)urea
CID 46860185
[3-[(2,4-dimethylphenyl)carbamoylamino]phenyl] acetate
CID 108865160
N-(2,4-dimethylphenyl)-2-(3-methoxyanilino)acetamide
CID 7636776
methyl 3-[(2,4-dimethylphenyl)carbamoylamino]benzoate
CID 108991298
1-(5-bromo-4-fluoro-2-methylphenyl)-3-(3-methoxyphenyl)urea
CID 103269220
1-(2,4-dihydroxyphenyl)-3-(3-methoxyphenyl)urea
CID 69014425
1-(3-methoxyphenyl)-3-(4-methoxyphenyl)urea
CID 872322
N-[3-[(3-methoxyphenyl)carbamoylamino]phenyl]acetamide
CID 6467465
N-(2,4-dimethylphenyl)-2-(3-methoxyanilino)pyrimidine-5-carboxamide
CID 109266400
2-(2,4-dimethylphenyl)-N-(3-methoxyphenyl)acetamide
CID 56920709
ethyl 3-[(4-methoxy-2-methylphenyl)carbamoylamino]benzoate
CID 46860218
1-(4-methoxy-2-methylphenyl)-3-(2-phenoxypyrimidin-5-yl)urea
CID 122302256

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea?
The IUPAC name of 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea (CID 6469067) is 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea?
The canonical SMILES for 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea is COc1cccc(NC(=O)Nc2ccc(C)cc2C)c1.
What is the InChIKey of 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea?
The InChIKey is AXJZHHALHMKXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-7-8-15(12(2)9-11)18-16(19)17-13-5-4-6-14(10-13)20-3/h4-10H,1-3H3,(H2,17,18,19).
What are the key properties of 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea?
1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea has a molecular weight of 270.33 g/mol, XLogP of 3.96, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea is sourced from PubChem (CID 6469067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).