[1-(2-hydroxyphenyl)ethylideneamino]urea

C9H11N3O2 — CID 2732242

IUPAC[1-(2-hydroxyphenyl)ethylideneamino]urea
SMILESCC(=NNC(N)=O)c1ccccc1O
InChIInChI=1S/C9H11N3O2/c1-6(11-12-9(10)14)7-4-2-3-5-8(7)13/h2-5,13H,1H3,(H3,10,12,14)
InChIKeySLSXRIZAOSGASD-UHFFFAOYSA-N
MW193.21 g/mol
LogP0.78
Rot. Bonds2

About [1-(2-hydroxyphenyl)ethylideneamino]urea

[1-(2-hydroxyphenyl)ethylideneamino]urea (PubChem CID 2732242) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is [1-(2-hydroxyphenyl)ethylideneamino]urea.

Molecular Properties

Compound Name[1-(2-hydroxyphenyl)ethylideneamino]urea
PubChem CID2732242
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name[1-(2-hydroxyphenyl)ethylideneamino]urea
SMILESCC(=NNC(N)=O)c1ccccc1O
InChIInChI=1S/C9H11N3O2/c1-6(11-12-9(10)14)7-4-2-3-5-8(7)13/h2-5,13H,1H3,(H3,10,12,14)
InChIKeySLSXRIZAOSGASD-UHFFFAOYSA-N
XLogP0.78
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135472588
[1-(2-hydroxy-5-methylphenyl)ethylideneamino]urea
CID 4521675
2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135688203
1-N,3-N-bis[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzene-1,3-dicarboxamide
CID 135656933
N-[1-(2-hydroxyphenyl)ethylideneamino]cyclopropanecarboxamide
CID 3541547
N-[1-(2-hydroxyphenyl)ethylideneamino]-2-(methylamino)benzamide
CID 136660084
(2S)-N-[(Z)-1-(2-hydroxyphenyl)ethylideneamino]-2-[(2S)-1-[(2Z)-2-[1-(2-hydroxyphenyl)ethylidene]hydrazinyl]-1-oxopropan-2-yl]sulfanylpropanamide
CID 136759335
[(Z)-1-[2-(difluoromethoxy)phenyl]ethylideneamino]urea
CID 9017353
5-bromo-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]furan-2-carboxamide
CID 135685001
4-bromo-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135643111
N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-hydroxybenzamide
CID 708171
N-[(Z)-1-(2-hydroxyphenyl)ethylideneamino]-2-methoxybenzamide
CID 144899093

Frequently Asked Questions

What is the IUPAC name of [1-(2-hydroxyphenyl)ethylideneamino]urea?
The IUPAC name of [1-(2-hydroxyphenyl)ethylideneamino]urea (CID 2732242) is [1-(2-hydroxyphenyl)ethylideneamino]urea.
What is the SMILES notation for [1-(2-hydroxyphenyl)ethylideneamino]urea?
The canonical SMILES for [1-(2-hydroxyphenyl)ethylideneamino]urea is CC(=NNC(N)=O)c1ccccc1O.
What is the InChIKey of [1-(2-hydroxyphenyl)ethylideneamino]urea?
The InChIKey is SLSXRIZAOSGASD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c1-6(11-12-9(10)14)7-4-2-3-5-8(7)13/h2-5,13H,1H3,(H3,10,12,14).
What are the key properties of [1-(2-hydroxyphenyl)ethylideneamino]urea?
[1-(2-hydroxyphenyl)ethylideneamino]urea has a molecular weight of 193.21 g/mol, XLogP of 0.78, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-hydroxyphenyl)ethylideneamino]urea is sourced from PubChem (CID 2732242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).