[(2-methylphenyl)-phenylmethyl]urea

C15H16N2O — CID 2849790

IUPAC[(2-methylphenyl)-phenylmethyl]urea
SMILESCc1ccccc1C(NC(N)=O)c1ccccc1
InChIInChI=1S/C15H16N2O/c1-11-7-5-6-10-13(11)14(17-15(16)18)12-8-3-2-4-9-12/h2-10,14H,1H3,(H3,16,17,18)
InChIKeyVLBUUPJRYPTPGB-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.75
Rot. Bonds3

About [(2-methylphenyl)-phenylmethyl]urea

[(2-methylphenyl)-phenylmethyl]urea (PubChem CID 2849790) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is [(2-methylphenyl)-phenylmethyl]urea.

Molecular Properties

Compound Name[(2-methylphenyl)-phenylmethyl]urea
PubChem CID2849790
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name[(2-methylphenyl)-phenylmethyl]urea
SMILESCc1ccccc1C(NC(N)=O)c1ccccc1
InChIInChI=1S/C15H16N2O/c1-11-7-5-6-10-13(11)14(17-15(16)18)12-8-3-2-4-9-12/h2-10,14H,1H3,(H3,16,17,18)
InChIKeyVLBUUPJRYPTPGB-UHFFFAOYSA-N
XLogP2.75
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(2-methylphenyl)-phenylmethyl]urea?
The IUPAC name of [(2-methylphenyl)-phenylmethyl]urea (CID 2849790) is [(2-methylphenyl)-phenylmethyl]urea.
What is the SMILES notation for [(2-methylphenyl)-phenylmethyl]urea?
The canonical SMILES for [(2-methylphenyl)-phenylmethyl]urea is Cc1ccccc1C(NC(N)=O)c1ccccc1.
What is the InChIKey of [(2-methylphenyl)-phenylmethyl]urea?
The InChIKey is VLBUUPJRYPTPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-11-7-5-6-10-13(11)14(17-15(16)18)12-8-3-2-4-9-12/h2-10,14H,1H3,(H3,16,17,18).
What are the key properties of [(2-methylphenyl)-phenylmethyl]urea?
[(2-methylphenyl)-phenylmethyl]urea has a molecular weight of 240.31 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-methylphenyl)-phenylmethyl]urea is sourced from PubChem (CID 2849790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).