4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide

C14H13ClN2O3 — CID 114323334

IUPAC4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide
SMILESN/C(=N/O)c1ccc(Cl)cc1OCc1cccc(O)c1
InChIInChI=1S/C14H13ClN2O3/c15-10-4-5-12(14(16)17-19)13(7-10)20-8-9-2-1-3-11(18)6-9/h1-7,18-19H,8H2,(H2,16,17)
InChIKeyHZFQCXVGQCUXOC-UHFFFAOYSA-N
MW292.72 g/mol
LogP2.72
Rot. Bonds4

About 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide

4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide (PubChem CID 114323334) has the molecular formula C14H13ClN2O3 and a molecular weight of 292.72 g/mol. Its IUPAC name is 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide.

Molecular Properties

Compound Name4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide
PubChem CID114323334
Molecular FormulaC14H13ClN2O3
Molecular Weight292.72 g/mol
Exact Mass292.06
IUPAC Name4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide
SMILESN/C(=N/O)c1ccc(Cl)cc1OCc1cccc(O)c1
InChIInChI=1S/C14H13ClN2O3/c15-10-4-5-12(14(16)17-19)13(7-10)20-8-9-2-1-3-11(18)6-9/h1-7,18-19H,8H2,(H2,16,17)
InChIKeyHZFQCXVGQCUXOC-UHFFFAOYSA-N
XLogP2.72
TPSA88.07 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.72
LogP ≤ 52.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide 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

4-chloro-N'-hydroxy-2-[(3-methoxyphenyl)methoxy]benzenecarboximidamide
CID 76984860
4-chloro-2-[(2,6-dichlorophenyl)methoxy]-N'-hydroxybenzenecarboximidamide
CID 114323357
4-chloro-2-[(2,6-difluorophenyl)methoxy]-N'-hydroxybenzenecarboximidamide
CID 114930346
2-[(4-bromophenyl)methoxy]-4-chloro-N'-hydroxybenzenecarboximidamide
CID 114323375
5-chloro-2-[(4-chlorophenyl)methoxy]-N'-hydroxybenzenecarboximidamide
CID 77056964
4-chloro-N'-hydroxy-2-(methoxymethoxy)benzenecarboximidamide
CID 114323364
4-chloro-2-[(3-fluorophenyl)methoxy]benzenecarbothioamide
CID 114323062
4-chloro-N'-hydroxy-2-(3-methylbutoxy)benzenecarboximidamide
CID 76984720
2-[(3-bromophenyl)methoxy]-N'-hydroxybenzenecarboximidamide
CID 24709005
4-bromo-N'-hydroxy-2-[(3-methoxyphenyl)methoxy]benzenecarboximidamide
CID 114904191
4-chloro-N'-hydroxy-2-(2-propoxyethoxy)benzenecarboximidamide
CID 55233057
4-chloro-2-[(3-methoxyphenyl)methoxy]benzenecarbothioamide
CID 63093520

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide?
The IUPAC name of 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide (CID 114323334) is 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide.
What is the SMILES notation for 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide?
The canonical SMILES for 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide is N/C(=N/O)c1ccc(Cl)cc1OCc1cccc(O)c1.
What is the InChIKey of 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide?
The InChIKey is HZFQCXVGQCUXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3/c15-10-4-5-12(14(16)17-19)13(7-10)20-8-9-2-1-3-11(18)6-9/h1-7,18-19H,8H2,(H2,16,17).
What are the key properties of 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide?
4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide has a molecular weight of 292.72 g/mol, XLogP of 2.72, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N'-hydroxy-2-[(3-hydroxyphenyl)methoxy]benzenecarboximidamide is sourced from PubChem (CID 114323334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).