N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide

C14H11ClN2O2 — CID 6893040

IUPACN-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide
SMILESO=C(N/N=C/c1ccc(Cl)cc1)c1ccccc1O
InChIInChI=1S/C14H11ClN2O2/c15-11-7-5-10(6-8-11)9-16-17-14(19)12-3-1-2-4-13(12)18/h1-9,18H,(H,17,19)/b16-9+
InChIKeyHNHWDPXSZPBROS-CXUHLZMHSA-N
MW274.71 g/mol
LogP2.81
Rot. Bonds3

About N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide

N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide (PubChem CID 6893040) has the molecular formula C14H11ClN2O2 and a molecular weight of 274.71 g/mol. Its IUPAC name is N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide
PubChem CID6893040
Molecular FormulaC14H11ClN2O2
Molecular Weight274.71 g/mol
Exact Mass274.05
IUPAC NameN-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide
SMILESO=C(N/N=C/c1ccc(Cl)cc1)c1ccccc1O
InChIInChI=1S/C14H11ClN2O2/c15-11-7-5-10(6-8-11)9-16-17-14(19)12-3-1-2-4-13(12)18/h1-9,18H,(H,17,19)/b16-9+
InChIKeyHNHWDPXSZPBROS-CXUHLZMHSA-N
XLogP2.81
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.71
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide?
The IUPAC name of N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide (CID 6893040) is N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide.
What is the SMILES notation for N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide?
The canonical SMILES for N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide is O=C(N/N=C/c1ccc(Cl)cc1)c1ccccc1O.
What is the InChIKey of N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide?
The InChIKey is HNHWDPXSZPBROS-CXUHLZMHSA-N. The full InChI is InChI=1S/C14H11ClN2O2/c15-11-7-5-10(6-8-11)9-16-17-14(19)12-3-1-2-4-13(12)18/h1-9,18H,(H,17,19)/b16-9+.
What are the key properties of N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide?
N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide has a molecular weight of 274.71 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide is sourced from PubChem (CID 6893040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).