1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea

C15H16N2O4 — CID 22099500

IUPAC1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea
SMILESCOc1cc(OC)c(NC(=O)Nc2ccccc2)cc1O
InChIInChI=1S/C15H16N2O4/c1-20-13-9-14(21-2)12(18)8-11(13)17-15(19)16-10-6-4-3-5-7-10/h3-9,18H,1-2H3,(H2,16,17,19)
InChIKeyHLYZZJJRULYOMI-UHFFFAOYSA-N
MW288.30 g/mol
LogP3.05
Rot. Bonds4

About 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea

1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea (PubChem CID 22099500) has the molecular formula C15H16N2O4 and a molecular weight of 288.30 g/mol. Its IUPAC name is 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea.

Molecular Properties

Compound Name1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea
PubChem CID22099500
Molecular FormulaC15H16N2O4
Molecular Weight288.30 g/mol
Exact Mass288.11
IUPAC Name1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea
SMILESCOc1cc(OC)c(NC(=O)Nc2ccccc2)cc1O
InChIInChI=1S/C15H16N2O4/c1-20-13-9-14(21-2)12(18)8-11(13)17-15(19)16-10-6-4-3-5-7-10/h3-9,18H,1-2H3,(H2,16,17,19)
InChIKeyHLYZZJJRULYOMI-UHFFFAOYSA-N
XLogP3.05
TPSA79.82 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 53.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-anilino-2-methoxyphenyl)-3-phenylurea
CID 110179401
N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide
CID 3546373
2-amino-N-[4,5-dimethoxy-2-(phenylcarbamoylamino)phenyl]acetamide
CID 39184918
ethyl 4-hydroxy-5-methoxy-2-[2-[4-(phenylcarbamoylamino)phenyl]propanoylamino]benzoate
CID 70105157
1-(2,4-dimethoxy-3-methylphenyl)-3-phenylurea
CID 110774594
1-(4,5-dimethoxy-2-nitrophenyl)-3-phenylurea
CID 110446745
N-[4-[(3-chlorophenyl)carbamoylamino]-2,5-dimethoxyphenyl]benzamide
CID 19187598
4-[(2-methoxyphenyl)carbamoylamino]benzoic acid
CID 853793
1-(5-acetyl-4-hydroxy-2-methoxyphenyl)-3-(4-fluorophenyl)urea
CID 162371292
1-(5-chloro-2,4-dimethoxyphenyl)-3-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]urea
CID 50827293
1-(2-methoxy-5-methylphenyl)-3-(4-methylphenyl)urea
CID 16640797
N-[4-[(4-chloro-2,5-dimethoxyphenyl)carbamoylamino]phenyl]acetamide
CID 108992307

Frequently Asked Questions

What is the IUPAC name of 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea?
The IUPAC name of 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea (CID 22099500) is 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea.
What is the SMILES notation for 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea?
The canonical SMILES for 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea is COc1cc(OC)c(NC(=O)Nc2ccccc2)cc1O.
What is the InChIKey of 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea?
The InChIKey is HLYZZJJRULYOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4/c1-20-13-9-14(21-2)12(18)8-11(13)17-15(19)16-10-6-4-3-5-7-10/h3-9,18H,1-2H3,(H2,16,17,19).
What are the key properties of 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea?
1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea has a molecular weight of 288.30 g/mol, XLogP of 3.05, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea is sourced from PubChem (CID 22099500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).