1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea

C22H20F2N2O2 — CID 141080201

IUPAC1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea
SMILESO=C(NCCc1ccc(OCc2ccccc2)cc1)Nc1ccc(F)cc1F
InChIInChI=1S/C22H20F2N2O2/c23-18-8-11-21(20(24)14-18)26-22(27)25-13-12-16-6-9-19(10-7-16)28-15-17-4-2-1-3-5-17/h1-11,14H,12-13,15H2,(H2,25,26,27)
InChIKeyFOPSXXQHJOTZRK-UHFFFAOYSA-N
MW382.41 g/mol
LogP4.91
Rot. Bonds7

About 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea

1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea (PubChem CID 141080201) has the molecular formula C22H20F2N2O2 and a molecular weight of 382.41 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea
PubChem CID141080201
Molecular FormulaC22H20F2N2O2
Molecular Weight382.41 g/mol
Exact Mass382.15
IUPAC Name1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea
SMILESO=C(NCCc1ccc(OCc2ccccc2)cc1)Nc1ccc(F)cc1F
InChIInChI=1S/C22H20F2N2O2/c23-18-8-11-21(20(24)14-18)26-22(27)25-13-12-16-6-9-19(10-7-16)28-15-17-4-2-1-3-5-17/h1-11,14H,12-13,15H2,(H2,25,26,27)
InChIKeyFOPSXXQHJOTZRK-UHFFFAOYSA-N
XLogP4.91
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.41
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-difluorophenyl)-3-(4-phenylbutyl)urea
CID 24818673
1-(2,4-difluorophenyl)-3-[2-(3-fluorophenyl)ethyl]urea
CID 46647390
2-[4-[2-[(2,4-difluorophenyl)carbamoylamino]ethyl]phenoxy]-2-methylpropanoic acid
CID 10619640
1-(2,4-difluorophenyl)-3-[3-(2-phenylethoxy)propyl]urea
CID 47050815
3-(2,4-difluoroanilino)-N-(4-phenylmethoxyphenyl)propanamide
CID 109042006
N-(2,4-difluorophenyl)-2-(4-phenylmethoxyanilino)acetamide
CID 37220850
2-[[4-[(4-fluorophenyl)methoxy]phenyl]methylsulfonyl]-N-(2-phenylethyl)propanamide
CID 154859573
1-(2,4-difluorophenyl)-3-(4-phenylmethoxyphenyl)thiourea
CID 19648747
2-(2,4-difluoroanilino)-N-(4-phenylmethoxyphenyl)acetamide
CID 109010754
1-(2,4-difluorophenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea
CID 883790
1-[2-(4-bromophenoxy)ethyl]-3-(2,4-difluorophenyl)urea
CID 112971370
1-(2-fluorophenyl)-3-[2-(4-methoxyphenyl)ethyl]urea
CID 3548825

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea?
The IUPAC name of 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea (CID 141080201) is 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea.
What is the SMILES notation for 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea?
The canonical SMILES for 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea is O=C(NCCc1ccc(OCc2ccccc2)cc1)Nc1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea?
The InChIKey is FOPSXXQHJOTZRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F2N2O2/c23-18-8-11-21(20(24)14-18)26-22(27)25-13-12-16-6-9-19(10-7-16)28-15-17-4-2-1-3-5-17/h1-11,14H,12-13,15H2,(H2,25,26,27).
What are the key properties of 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea?
1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea has a molecular weight of 382.41 g/mol, XLogP of 4.91, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea is sourced from PubChem (CID 141080201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).