1-(4-anilino-2-methoxyphenyl)-3-phenylurea

C20H19N3O2 — CID 110179401

IUPAC1-(4-anilino-2-methoxyphenyl)-3-phenylurea
SMILESCOc1cc(Nc2ccccc2)ccc1NC(=O)Nc1ccccc1
InChIInChI=1S/C20H19N3O2/c1-25-19-14-17(21-15-8-4-2-5-9-15)12-13-18(19)23-20(24)22-16-10-6-3-7-11-16/h2-14,21H,1H3,(H2,22,23,24)
InChIKeyWYRGSWLWCAWWFL-UHFFFAOYSA-N
MW333.39 g/mol
LogP5.08
Rot. Bonds5

About 1-(4-anilino-2-methoxyphenyl)-3-phenylurea

1-(4-anilino-2-methoxyphenyl)-3-phenylurea (PubChem CID 110179401) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 1-(4-anilino-2-methoxyphenyl)-3-phenylurea.

Molecular Properties

Compound Name1-(4-anilino-2-methoxyphenyl)-3-phenylurea
PubChem CID110179401
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name1-(4-anilino-2-methoxyphenyl)-3-phenylurea
SMILESCOc1cc(Nc2ccccc2)ccc1NC(=O)Nc1ccccc1
InChIInChI=1S/C20H19N3O2/c1-25-19-14-17(21-15-8-4-2-5-9-15)12-13-18(19)23-20(24)22-16-10-6-3-7-11-16/h2-14,21H,1H3,(H2,22,23,24)
InChIKeyWYRGSWLWCAWWFL-UHFFFAOYSA-N
XLogP5.08
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.39
LogP ≤ 55.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(4-anilino-2-methoxyphenyl)-3-phenylurea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-anilino-2-methoxyphenyl)-3-methylurea
CID 110178450
1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea
CID 22099500
N-(4-anilino-2-methoxyphenyl)adamantane-1-carboxamide
CID 110179453
1-N-iodo-2-methoxy-4-N-phenylbenzene-1,4-diamine
CID 154558823
1-[1-(2-amino-2-methylpropyl)indol-5-yl]-3-(4-anilino-2-methoxyphenyl)urea
CID 91566130
4-[(2-methoxyphenyl)carbamoylamino]benzoic acid
CID 853793
1-(2,4-dimethoxy-3-methylphenyl)-3-phenylurea
CID 110774594
1-[6-(3,4-dimethoxyanilino)-3-pyridinyl]-3-phenylurea
CID 113020117
CID 168763596
CID 168763596
2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide
CID 58730700
1-(2,4-dimethoxyphenyl)-3-(4-iodophenyl)urea
CID 2209592
1-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-3-phenylurea
CID 113034717

Frequently Asked Questions

What is the IUPAC name of 1-(4-anilino-2-methoxyphenyl)-3-phenylurea?
The IUPAC name of 1-(4-anilino-2-methoxyphenyl)-3-phenylurea (CID 110179401) is 1-(4-anilino-2-methoxyphenyl)-3-phenylurea.
What is the SMILES notation for 1-(4-anilino-2-methoxyphenyl)-3-phenylurea?
The canonical SMILES for 1-(4-anilino-2-methoxyphenyl)-3-phenylurea is COc1cc(Nc2ccccc2)ccc1NC(=O)Nc1ccccc1.
What is the InChIKey of 1-(4-anilino-2-methoxyphenyl)-3-phenylurea?
The InChIKey is WYRGSWLWCAWWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-25-19-14-17(21-15-8-4-2-5-9-15)12-13-18(19)23-20(24)22-16-10-6-3-7-11-16/h2-14,21H,1H3,(H2,22,23,24).
What are the key properties of 1-(4-anilino-2-methoxyphenyl)-3-phenylurea?
1-(4-anilino-2-methoxyphenyl)-3-phenylurea has a molecular weight of 333.39 g/mol, XLogP of 5.08, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-anilino-2-methoxyphenyl)-3-phenylurea is sourced from PubChem (CID 110179401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).