1-(3-methylphenyl)-3-(4-methylphenyl)urea

C15H16N2O — CID 12560219

IUPAC1-(3-methylphenyl)-3-(4-methylphenyl)urea
SMILESCc1ccc(NC(=O)Nc2cccc(C)c2)cc1
InChIInChI=1S/C15H16N2O/c1-11-6-8-13(9-7-11)16-15(18)17-14-5-3-4-12(2)10-14/h3-10H,1-2H3,(H2,16,17,18)
InChIKeyPRVCBVJGABWHPY-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.95
Rot. Bonds2

About 1-(3-methylphenyl)-3-(4-methylphenyl)urea

1-(3-methylphenyl)-3-(4-methylphenyl)urea (PubChem CID 12560219) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 1-(3-methylphenyl)-3-(4-methylphenyl)urea.

Molecular Properties

Compound Name1-(3-methylphenyl)-3-(4-methylphenyl)urea
PubChem CID12560219
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name1-(3-methylphenyl)-3-(4-methylphenyl)urea
SMILESCc1ccc(NC(=O)Nc2cccc(C)c2)cc1
InChIInChI=1S/C15H16N2O/c1-11-6-8-13(9-7-11)16-15(18)17-14-5-3-4-12(2)10-14/h3-10H,1-2H3,(H2,16,17,18)
InChIKeyPRVCBVJGABWHPY-UHFFFAOYSA-N
XLogP3.95
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;1-(3-methylphenyl)-3-(4-methylphenyl)urea
CID 144571774
1-(3-methylphenyl)-3-[4-[4-[(3-methylphenyl)carbamoylamino]phenyl]phenyl]urea
CID 1239967
1-(3,4-dimethylphenyl)-3-(3-methylphenyl)urea
CID 2985670
1-hydroxy-3-(3-methylphenyl)urea
CID 10034960
1-[4-(diethylamino)phenyl]-3-(3-methylphenyl)urea
CID 71323967
1-(3-chloro-4-methylphenyl)-3-(3-methylphenyl)urea
CID 727838
1-(3-methylphenyl)-3-[4-(prop-2-enylcarbamoylamino)phenyl]urea
CID 36517218
4-methyl-N-[4-[(3-methylphenyl)carbamoylamino]phenyl]sulfonylbenzamide
CID 22441702
1-[3-(aminomethyl)phenyl]-3-(4-methylphenyl)urea
CID 43245991
1-(2-fluoro-5-methylphenyl)-3-(3-methylphenyl)urea
CID 6467653
N-(3-methylphenyl)acetamide
CID 10843
[4-[(3-methylphenyl)carbamoylamino]phenyl] thiocyanate
CID 108887985

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)-3-(4-methylphenyl)urea?
The IUPAC name of 1-(3-methylphenyl)-3-(4-methylphenyl)urea (CID 12560219) is 1-(3-methylphenyl)-3-(4-methylphenyl)urea.
What is the SMILES notation for 1-(3-methylphenyl)-3-(4-methylphenyl)urea?
The canonical SMILES for 1-(3-methylphenyl)-3-(4-methylphenyl)urea is Cc1ccc(NC(=O)Nc2cccc(C)c2)cc1.
What is the InChIKey of 1-(3-methylphenyl)-3-(4-methylphenyl)urea?
The InChIKey is PRVCBVJGABWHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-11-6-8-13(9-7-11)16-15(18)17-14-5-3-4-12(2)10-14/h3-10H,1-2H3,(H2,16,17,18).
What are the key properties of 1-(3-methylphenyl)-3-(4-methylphenyl)urea?
1-(3-methylphenyl)-3-(4-methylphenyl)urea has a molecular weight of 240.31 g/mol, XLogP of 3.95, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)-3-(4-methylphenyl)urea is sourced from PubChem (CID 12560219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).