3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide

C14H11ClN2O2 — CID 5407450

IUPAC3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide
SMILESO=C(N/N=C\c1cccc(O)c1)c1cccc(Cl)c1
InChIInChI=1S/C14H11ClN2O2/c15-12-5-2-4-11(8-12)14(19)17-16-9-10-3-1-6-13(18)7-10/h1-9,18H,(H,17,19)/b16-9-
InChIKeyRJLJKHDNRMSFQN-SXGWCWSVSA-N
MW274.71 g/mol
LogP2.81
Rot. Bonds3

About 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide

3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide (PubChem CID 5407450) has the molecular formula C14H11ClN2O2 and a molecular weight of 274.71 g/mol. Its IUPAC name is 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide
PubChem CID5407450
Molecular FormulaC14H11ClN2O2
Molecular Weight274.71 g/mol
Exact Mass274.05
IUPAC Name3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide
SMILESO=C(N/N=C\c1cccc(O)c1)c1cccc(Cl)c1
InChIInChI=1S/C14H11ClN2O2/c15-12-5-2-4-11(8-12)14(19)17-16-9-10-3-1-6-13(18)7-10/h1-9,18H,(H,17,19)/b16-9-
InChIKeyRJLJKHDNRMSFQN-SXGWCWSVSA-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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Related Compounds

N-[(Z)-benzylideneamino]-3-chlorobenzamide
CID 5409510
3-chloro-N-[(Z)-(3-phenoxyphenyl)methylideneamino]benzamide
CID 94847748
N-[(E)-benzylideneamino]-3-hydroxybenzamide
CID 6869110
3-chloro-N-[(4-fluorophenyl)methylideneamino]benzamide
CID 771424
3-chloro-N-[(E)-naphthalen-2-ylmethylideneamino]benzamide
CID 5332427
3-chloro-N-[(3-phenylmethoxyphenyl)methylideneamino]benzamide
CID 5211161
N-[(3-bromophenyl)methylideneamino]-3-hydroxybenzamide
CID 2695972
4-[(Z)-[(3-chlorobenzoyl)hydrazinylidene]methyl]benzoate
CID 9174979
3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide
CID 6911430
N-[(E)-(3-chlorophenyl)methylideneamino]-4-hydroxy-3-methoxybenzamide
CID 71537752
N-[(3-chlorophenyl)methylideneamino]-3,4-dimethoxybenzamide
CID 2693736
3-chloro-N-[(Z)-(4-propan-2-yloxyphenyl)methylideneamino]benzamide
CID 5456482

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide?
The IUPAC name of 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide (CID 5407450) is 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide.
What is the SMILES notation for 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide?
The canonical SMILES for 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide is O=C(N/N=C\c1cccc(O)c1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide?
The InChIKey is RJLJKHDNRMSFQN-SXGWCWSVSA-N. The full InChI is InChI=1S/C14H11ClN2O2/c15-12-5-2-4-11(8-12)14(19)17-16-9-10-3-1-6-13(18)7-10/h1-9,18H,(H,17,19)/b16-9-.
What are the key properties of 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide?
3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide 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 3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide is sourced from PubChem (CID 5407450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).