1-methyl-3-(3-phenoxyphenyl)urea

C14H14N2O2 — CID 47127200

IUPAC1-methyl-3-(3-phenoxyphenyl)urea
SMILESCNC(=O)Nc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C14H14N2O2/c1-15-14(17)16-11-6-5-9-13(10-11)18-12-7-3-2-4-8-12/h2-10H,1H3,(H2,15,16,17)
InChIKeyNZQLTZLVXSBYMH-UHFFFAOYSA-N
MW242.28 g/mol
LogP3.23
Rot. Bonds3

About 1-methyl-3-(3-phenoxyphenyl)urea

1-methyl-3-(3-phenoxyphenyl)urea (PubChem CID 47127200) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 1-methyl-3-(3-phenoxyphenyl)urea.

Molecular Properties

Compound Name1-methyl-3-(3-phenoxyphenyl)urea
PubChem CID47127200
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name1-methyl-3-(3-phenoxyphenyl)urea
SMILESCNC(=O)Nc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C14H14N2O2/c1-15-14(17)16-11-6-5-9-13(10-11)18-12-7-3-2-4-8-12/h2-10H,1H3,(H2,15,16,17)
InChIKeyNZQLTZLVXSBYMH-UHFFFAOYSA-N
XLogP3.23
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-ethoxyphenyl)-3-methylurea
CID 115584262
2-methyl-2-(methylamino)-N-(3-phenoxyphenyl)propanamide
CID 62845831
1-(3-chloro-4-phenoxyphenyl)-3-methylurea
CID 139434055
[3-[(4-phenoxyphenyl)carbamoylamino]phenyl] acetate
CID 108865140
1-methoxy-1-methyl-3-(3-phenoxyphenyl)urea
CID 13424071
4-methyl-N-(3-phenoxyphenyl)benzamide
CID 59304535
2-methyl-N-(3-phenoxyphenyl)butanamide
CID 53364670
1-(3,7-dimethyl-1-bicyclo[3.3.1]nonanyl)-3-(3-phenoxyphenyl)urea
CID 143220096
3-chloro-2,2-dimethyl-N-(3-phenoxyphenyl)propanamide
CID 63680730
N-methoxy-3-phenoxyaniline
CID 90688975
(2E)-2-hydroxyimino-N-(3-phenoxyphenyl)acetamide
CID 10988880
N'-(3-methoxyphenyl)-N-(4-phenoxyphenyl)oxamide
CID 44999403

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(3-phenoxyphenyl)urea?
The IUPAC name of 1-methyl-3-(3-phenoxyphenyl)urea (CID 47127200) is 1-methyl-3-(3-phenoxyphenyl)urea.
What is the SMILES notation for 1-methyl-3-(3-phenoxyphenyl)urea?
The canonical SMILES for 1-methyl-3-(3-phenoxyphenyl)urea is CNC(=O)Nc1cccc(Oc2ccccc2)c1.
What is the InChIKey of 1-methyl-3-(3-phenoxyphenyl)urea?
The InChIKey is NZQLTZLVXSBYMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-15-14(17)16-11-6-5-9-13(10-11)18-12-7-3-2-4-8-12/h2-10H,1H3,(H2,15,16,17).
What are the key properties of 1-methyl-3-(3-phenoxyphenyl)urea?
1-methyl-3-(3-phenoxyphenyl)urea has a molecular weight of 242.28 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(3-phenoxyphenyl)urea is sourced from PubChem (CID 47127200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).