1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea

C23H24N2O3 — CID 108992099

IUPAC1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea
SMILESCC(C)Oc1ccccc1NC(=O)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C23H24N2O3/c1-17(2)28-22-11-7-6-10-21(22)25-23(26)24-19-12-14-20(15-13-19)27-16-18-8-4-3-5-9-18/h3-15,17H,16H2,1-2H3,(H2,24,25,26)
InChIKeyCSZNGFDLNYOMOL-UHFFFAOYSA-N
MW376.46 g/mol
LogP5.70
Rot. Bonds7

About 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea

1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea (PubChem CID 108992099) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea.

Molecular Properties

Compound Name1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea
PubChem CID108992099
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC Name1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea
SMILESCC(C)Oc1ccccc1NC(=O)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C23H24N2O3/c1-17(2)28-22-11-7-6-10-21(22)25-23(26)24-19-12-14-20(15-13-19)27-16-18-8-4-3-5-9-18/h3-15,17H,16H2,1-2H3,(H2,24,25,26)
InChIKeyCSZNGFDLNYOMOL-UHFFFAOYSA-N
XLogP5.70
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.46
LogP ≤ 55.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-phenylmethoxyphenyl)-3-propan-2-ylurea
CID 110755142
(2R)-N-(2-methoxyphenyl)-2-(4-phenylmethoxyanilino)propanamide
CID 7830477
N-(4-ethoxyphenyl)-N'-(2-propan-2-yloxyphenyl)oxamide
CID 108987274
N-[(4-phenylmethoxyphenyl)carbamothioyl]-2-propan-2-yloxybenzamide
CID 17045921
N-(2-phenylmethoxyphenyl)-2-(2-propan-2-yloxyanilino)acetamide
CID 54828582
(2R)-N-(4-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 92681869
(2S)-2-[(2S)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl]sulfanyl-N-(4-phenylmethoxyphenyl)propanamide
CID 98384376
2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide
CID 54824046
1-(4-phenylmethoxyphenyl)-3-(2,3,4-trifluorophenyl)urea
CID 108992623
1-(4-phenylmethoxyphenyl)-3-quinolin-8-ylurea
CID 108992618
(2S)-2-(4-chlorophenoxy)-N-(4-phenylmethoxyphenyl)propanamide
CID 9233741
N-[2-(difluoromethoxy)phenyl]-4-phenylmethoxybenzamide
CID 2953331

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea?
The IUPAC name of 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea (CID 108992099) is 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea.
What is the SMILES notation for 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea?
The canonical SMILES for 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea is CC(C)Oc1ccccc1NC(=O)Nc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea?
The InChIKey is CSZNGFDLNYOMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-17(2)28-22-11-7-6-10-21(22)25-23(26)24-19-12-14-20(15-13-19)27-16-18-8-4-3-5-9-18/h3-15,17H,16H2,1-2H3,(H2,24,25,26).
What are the key properties of 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea?
1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea has a molecular weight of 376.46 g/mol, XLogP of 5.70, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenylmethoxyphenyl)-3-(2-propan-2-yloxyphenyl)urea is sourced from PubChem (CID 108992099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).