(1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea

C18H15N3O2 — CID 134097848

IUPAC(1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea
SMILESO=C(/N=c1/ccn(O)c(-c2ccccc2)c1)Nc1ccccc1
InChIInChI=1S/C18H15N3O2/c22-18(19-15-9-5-2-6-10-15)20-16-11-12-21(23)17(13-16)14-7-3-1-4-8-14/h1-13,23H,(H,19,22)/b20-16-
InChIKeyNXRBTRGCZPICRS-SILNSSARSA-N
MW305.34 g/mol
LogP3.53
Rot. Bonds2

About (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea

(1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea (PubChem CID 134097848) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea.

Molecular Properties

Compound Name(1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea
PubChem CID134097848
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name(1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea
SMILESO=C(/N=c1/ccn(O)c(-c2ccccc2)c1)Nc1ccccc1
InChIInChI=1S/C18H15N3O2/c22-18(19-15-9-5-2-6-10-15)20-16-11-12-21(23)17(13-16)14-7-3-1-4-8-14/h1-13,23H,(H,19,22)/b20-16-
InChIKeyNXRBTRGCZPICRS-SILNSSARSA-N
XLogP3.53
TPSA66.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(1-hydroxy-2-methyl-4-pyridinylidene)-3-phenylurea
CID 54070564
(1Z)-1-[2-(benzenesulfonyl)-1-hydroxy-4-pyridinylidene]-3-phenylurea
CID 134095397
(1Z)-1-[2-(1,1,2,2,3,3,3-heptafluoropropyl)-1-hydroxy-4-pyridinylidene]-3-phenylurea
CID 134122504
(1E)-1-(1-hydroxyquinolin-5-ylidene)-3-phenylurea
CID 134113276
1-(2-hydroxypyridazin-3-ylidene)-3-phenylurea
CID 54374887
1-(1-hydroxy-2-oxo-4-pyridinyl)-3-phenylurea;hydrochloride
CID 134121177
1-(4-chlorophenyl)-3-(1-phenylpyridazin-4-ylidene)urea
CID 54424116
1-(1-hydroxy-4-pyridinylidene)-3-phenylthiourea
CID 134114156
(1E)-1-(4-oxo-1,3-thiazolidin-2-ylidene)-3-phenylurea
CID 135501318
5-methyl-N,2-diphenylindole-1-carboxamide
CID 25170726
(1E)-1-(2-oxo-1,3-diphenyl-5-sulfanylimidazolidin-4-ylidene)-3-phenylurea
CID 15500443
phenylcarbamothioic S-acid;hydrofluoride
CID 175225521

Frequently Asked Questions

What is the IUPAC name of (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea?
The IUPAC name of (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea (CID 134097848) is (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea.
What is the SMILES notation for (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea?
The canonical SMILES for (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea is O=C(/N=c1/ccn(O)c(-c2ccccc2)c1)Nc1ccccc1.
What is the InChIKey of (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea?
The InChIKey is NXRBTRGCZPICRS-SILNSSARSA-N. The full InChI is InChI=1S/C18H15N3O2/c22-18(19-15-9-5-2-6-10-15)20-16-11-12-21(23)17(13-16)14-7-3-1-4-8-14/h1-13,23H,(H,19,22)/b20-16-.
What are the key properties of (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea?
(1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea has a molecular weight of 305.34 g/mol, XLogP of 3.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1-(1-hydroxy-2-phenyl-4-pyridinylidene)-3-phenylurea is sourced from PubChem (CID 134097848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).