1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea

C15H15ClN2O — CID 6468848

IUPAC1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)NCc1ccccc1Cl
InChIInChI=1S/C15H15ClN2O/c1-11-6-2-5-9-14(11)18-15(19)17-10-12-7-3-4-8-13(12)16/h2-9H,10H2,1H3,(H2,17,18,19)
InChIKeySYVIWPJJJVORAH-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.97
Rot. Bonds3

About 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea

1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea (PubChem CID 6468848) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea.

Molecular Properties

Compound Name1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea
PubChem CID6468848
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)NCc1ccccc1Cl
InChIInChI=1S/C15H15ClN2O/c1-11-6-2-5-9-14(11)18-15(19)17-10-12-7-3-4-8-13(12)16/h2-9H,10H2,1H3,(H2,17,18,19)
InChIKeySYVIWPJJJVORAH-UHFFFAOYSA-N
XLogP3.97
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(2-chlorophenyl)methyl]-3-(3,4-dimethylphenyl)urea
CID 47192222
N-[(2-chlorophenyl)methyl]-N'-(2,3-dimethylphenyl)propanediamide
CID 108946597
N'-(2-chlorophenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 2174333
1-[2-(2-chlorophenyl)ethyl]-3-[(2-methylphenyl)methyl]urea
CID 60595877
1-(2,6-dichlorophenyl)-3-(2-methylphenyl)urea
CID 44721842
1-(3-chloro-2-methylphenyl)-3-(2-methylphenyl)urea
CID 19165606
1-[(2-bromophenyl)methyl]-3-(3-chloro-2-methylphenyl)urea
CID 17379764
ethyl N-[4-[(2-chlorophenyl)methylcarbamoylamino]phenyl]carbamate
CID 47039627
1-[(2-chlorophenyl)methyl]-3-[(4-methylphenyl)methyl]urea
CID 47133587
1-[(2-aminophenyl)methyl]-3-(2-chlorophenyl)urea
CID 5122456
1-[(2-chlorophenyl)methyl]-3-(4-methoxyphenyl)urea
CID 6469547
N-[(2-chlorophenyl)methyl]-2-(2,3-dimethylanilino)acetamide
CID 26416416

Frequently Asked Questions

What is the IUPAC name of 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea?
The IUPAC name of 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea (CID 6468848) is 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea.
What is the SMILES notation for 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea?
The canonical SMILES for 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea is Cc1ccccc1NC(=O)NCc1ccccc1Cl.
What is the InChIKey of 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea?
The InChIKey is SYVIWPJJJVORAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-11-6-2-5-9-14(11)18-15(19)17-10-12-7-3-4-8-13(12)16/h2-9H,10H2,1H3,(H2,17,18,19).
What are the key properties of 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea?
1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea has a molecular weight of 274.75 g/mol, XLogP of 3.97, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-chlorophenyl)methyl]-3-(2-methylphenyl)urea is sourced from PubChem (CID 6468848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).