N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide

C15H13BrN2O2 — CID 1274836

IUPACN-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide
SMILESCC(=NNC(=O)c1ccc(O)cc1)c1ccc(Br)cc1
InChIInChI=1S/C15H13BrN2O2/c1-10(11-2-6-13(16)7-3-11)17-18-15(20)12-4-8-14(19)9-5-12/h2-9,19H,1H3,(H,18,20)
InChIKeyUGWBDNRNXICOAG-UHFFFAOYSA-N
MW333.19 g/mol
LogP3.31
Rot. Bonds3

About N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide

N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide (PubChem CID 1274836) has the molecular formula C15H13BrN2O2 and a molecular weight of 333.19 g/mol. Its IUPAC name is N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide.

Molecular Properties

Compound NameN-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide
PubChem CID1274836
Molecular FormulaC15H13BrN2O2
Molecular Weight333.19 g/mol
Exact Mass332.02
IUPAC NameN-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide
SMILESCC(=NNC(=O)c1ccc(O)cc1)c1ccc(Br)cc1
InChIInChI=1S/C15H13BrN2O2/c1-10(11-2-6-13(16)7-3-11)17-18-15(20)12-4-8-14(19)9-5-12/h2-9,19H,1H3,(H,18,20)
InChIKeyUGWBDNRNXICOAG-UHFFFAOYSA-N
XLogP3.31
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.19
LogP ≤ 53.31
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)-1-(4-hydroxyphenyl)ethylideneamino]-4-methylbenzamide
CID 136661545
4-acetamido-N-[(Z)-1-(4-bromophenyl)ethylideneamino]benzamide
CID 6134709
4-bromo-N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 6062256
5-bromo-2-hydroxy-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide
CID 135706744
4-bromo-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135643111
4-benzamido-N-[(Z)-1-(4-bromophenyl)ethylideneamino]benzamide
CID 6272222
N-[(Z)-1-(4-hydroxyphenyl)ethylideneamino]-4-pyrrol-1-ylbenzamide
CID 136690135
4-bromo-N-(1-naphthalen-2-ylethylideneamino)benzamide
CID 4299606
N-[(Z)-1-(4-bromophenyl)ethylideneamino]-6-methylpyridine-3-carboxamide
CID 5370928
4-bromo-N-[1-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]ethylideneamino]benzamide
CID 3413334
N-[(Z)-1-(4-bromophenyl)ethylideneamino]-4-propoxybenzamide
CID 99945469
N-[1-(4-bromophenyl)ethylideneamino]-4-phenylmethoxybenzamide
CID 4933030

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide?
The IUPAC name of N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide (CID 1274836) is N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide.
What is the SMILES notation for N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide?
The canonical SMILES for N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide is CC(=NNC(=O)c1ccc(O)cc1)c1ccc(Br)cc1.
What is the InChIKey of N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide?
The InChIKey is UGWBDNRNXICOAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O2/c1-10(11-2-6-13(16)7-3-11)17-18-15(20)12-4-8-14(19)9-5-12/h2-9,19H,1H3,(H,18,20).
What are the key properties of N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide?
N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide has a molecular weight of 333.19 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-bromophenyl)ethylideneamino]-4-hydroxybenzamide is sourced from PubChem (CID 1274836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).