1-phenyl-3-(2-phenylmethoxyethyl)urea

C16H18N2O2 — CID 56923115

IUPAC1-phenyl-3-(2-phenylmethoxyethyl)urea
SMILESO=C(NCCOCc1ccccc1)Nc1ccccc1
InChIInChI=1S/C16H18N2O2/c19-16(18-15-9-5-2-6-10-15)17-11-12-20-13-14-7-3-1-4-8-14/h1-10H,11-13H2,(H2,17,18,19)
InChIKeyDJENAEFSNDMBET-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.02
Rot. Bonds6

About 1-phenyl-3-(2-phenylmethoxyethyl)urea

1-phenyl-3-(2-phenylmethoxyethyl)urea (PubChem CID 56923115) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 1-phenyl-3-(2-phenylmethoxyethyl)urea.

Molecular Properties

Compound Name1-phenyl-3-(2-phenylmethoxyethyl)urea
PubChem CID56923115
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name1-phenyl-3-(2-phenylmethoxyethyl)urea
SMILESO=C(NCCOCc1ccccc1)Nc1ccccc1
InChIInChI=1S/C16H18N2O2/c19-16(18-15-9-5-2-6-10-15)17-11-12-20-13-14-7-3-1-4-8-14/h1-10H,11-13H2,(H2,17,18,19)
InChIKeyDJENAEFSNDMBET-UHFFFAOYSA-N
XLogP3.02
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-phenoxyethyl)-3-(4-phenylmethoxyphenyl)urea
CID 112969756
1-[2-[2-(diethylamino)ethoxy]ethyl]-3-phenylurea
CID 110425086
1-(3,5-dimethyl-1,2-oxazol-4-yl)-3-(2-phenylmethoxyethyl)urea
CID 71982689
1-[(1S,2R)-2-methylcyclopropyl]-3-(2-phenylmethoxyethyl)urea
CID 96831919
1-(2-phenylmethoxyethyl)-3-(thian-4-yl)urea
CID 71981654
1-methyl-3-(3-phenylmethoxypropyl)urea
CID 47127496
N-phenyl-2-phenylmethoxyacetamide
CID 15220156
2-hydroxy-2-phenyl-N-(2-phenylmethoxyethyl)acetamide
CID 111578044
1-(4-phenoxybutyl)-3-phenylurea
CID 19353776
1-[2-(furan-2-yl)-2-hydroxyethyl]-3-(2-phenylmethoxyethyl)urea
CID 111619159
4-(2-methoxyethylcarbamoylamino)-N-phenylbenzamide
CID 52793053
1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea
CID 43010864

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3-(2-phenylmethoxyethyl)urea?
The IUPAC name of 1-phenyl-3-(2-phenylmethoxyethyl)urea (CID 56923115) is 1-phenyl-3-(2-phenylmethoxyethyl)urea.
What is the SMILES notation for 1-phenyl-3-(2-phenylmethoxyethyl)urea?
The canonical SMILES for 1-phenyl-3-(2-phenylmethoxyethyl)urea is O=C(NCCOCc1ccccc1)Nc1ccccc1.
What is the InChIKey of 1-phenyl-3-(2-phenylmethoxyethyl)urea?
The InChIKey is DJENAEFSNDMBET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c19-16(18-15-9-5-2-6-10-15)17-11-12-20-13-14-7-3-1-4-8-14/h1-10H,11-13H2,(H2,17,18,19).
What are the key properties of 1-phenyl-3-(2-phenylmethoxyethyl)urea?
1-phenyl-3-(2-phenylmethoxyethyl)urea has a molecular weight of 270.33 g/mol, XLogP of 3.02, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3-(2-phenylmethoxyethyl)urea is sourced from PubChem (CID 56923115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).