1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea

C15H16N2O3 — CID 86800658

IUPAC1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea
SMILESCOCc1ccccc1NC(=O)Nc1ccc(O)cc1
InChIInChI=1S/C15H16N2O3/c1-20-10-11-4-2-3-5-14(11)17-15(19)16-12-6-8-13(18)9-7-12/h2-9,18H,10H2,1H3,(H2,16,17,19)
InChIKeyZYJORGHRADZUNC-UHFFFAOYSA-N
MW272.30 g/mol
LogP3.18
Rot. Bonds4

About 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea

1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea (PubChem CID 86800658) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea
PubChem CID86800658
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea
SMILESCOCc1ccccc1NC(=O)Nc1ccc(O)cc1
InChIInChI=1S/C15H16N2O3/c1-20-10-11-4-2-3-5-14(11)17-15(19)16-12-6-8-13(18)9-7-12/h2-9,18H,10H2,1H3,(H2,16,17,19)
InChIKeyZYJORGHRADZUNC-UHFFFAOYSA-N
XLogP3.18
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 53.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea 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-[2-(methoxymethyl)phenyl]-3-methylurea
CID 115582115
(2R)-2-amino-N-[2-(methoxymethyl)phenyl]propanamide;hydrochloride
CID 119288747
N-[2-(methoxymethyl)phenyl]-2-(methylamino)propanamide
CID 62637466
1-(4-methoxyphenyl)-3-[2-(methylaminomethyl)phenyl]urea
CID 43602404
(E)-4-[2-(methoxymethyl)anilino]-4-oxobut-2-enoic acid
CID 54868087
2-amino-N-[2-(methoxymethyl)phenyl]-3-methylbutanamide
CID 43700969
N-[2-(methoxymethyl)phenyl]-5-(methylamino)pyridine-2-carboxamide
CID 104640992
N-[2-(methoxymethyl)phenyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604453
(2S)-2-amino-N-[2-(methoxymethyl)phenyl]-2-phenylacetamide
CID 104897233
4-amino-N-[2-(methoxymethyl)phenyl]butanamide
CID 43701002
N-tert-butyl-2-[[2-(methoxymethyl)phenyl]carbamoylamino]acetamide
CID 86989240
1-[2-(methoxymethyl)phenyl]-3-(pyridin-4-ylmethyl)urea
CID 47034851

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea?
The IUPAC name of 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea (CID 86800658) is 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea.
What is the SMILES notation for 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea?
The canonical SMILES for 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea is COCc1ccccc1NC(=O)Nc1ccc(O)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea?
The InChIKey is ZYJORGHRADZUNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-20-10-11-4-2-3-5-14(11)17-15(19)16-12-6-8-13(18)9-7-12/h2-9,18H,10H2,1H3,(H2,16,17,19).
What are the key properties of 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea?
1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea has a molecular weight of 272.30 g/mol, XLogP of 3.18, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)-3-[2-(methoxymethyl)phenyl]urea is sourced from PubChem (CID 86800658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).