[2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine

C14H13BrN2O — CID 168530074

IUPAC[2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine
SMILESNN=Cc1ccccc1OCc1cccc(Br)c1
InChIInChI=1S/C14H13BrN2O/c15-13-6-3-4-11(8-13)10-18-14-7-2-1-5-12(14)9-17-16/h1-9H,10,16H2
InChIKeyYERFAJWGVPUSII-UHFFFAOYSA-N
MW305.18 g/mol
LogP3.32
Rot. Bonds4

About [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine

[2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine (PubChem CID 168530074) has the molecular formula C14H13BrN2O and a molecular weight of 305.18 g/mol. Its IUPAC name is [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine.

Molecular Properties

Compound Name[2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine
PubChem CID168530074
Molecular FormulaC14H13BrN2O
Molecular Weight305.18 g/mol
Exact Mass304.02
IUPAC Name[2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine
SMILESNN=Cc1ccccc1OCc1cccc(Br)c1
InChIInChI=1S/C14H13BrN2O/c15-13-6-3-4-11(8-13)10-18-14-7-2-1-5-12(14)9-17-16/h1-9H,10,16H2
InChIKeyYERFAJWGVPUSII-UHFFFAOYSA-N
XLogP3.32
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.18
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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-phenylmethoxyphenyl)methylidenehydrazine
CID 78678885
[2-[(3-fluorophenyl)methoxy]phenyl]methylidenehydrazine
CID 168529846
[5-bromo-2-[(3-chlorophenyl)methoxy]phenyl]methylidenehydrazine
CID 168530433
N-[(Z)-[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]benzamide
CID 6262708
3-bromo-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]aniline
CID 19655678
3-[(3-bromophenyl)methoxy]-2-methylaniline
CID 43437900
5-bromo-N-[[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]-2-methoxybenzamide
CID 5213749
2-[(3-bromophenyl)methoxy]-N'-hydroxybenzenecarboximidamide
CID 24709005
4-[[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one
CID 56689092
1-[[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]-N-phenyltetrazol-5-amine
CID 23876451
2-(4-bromophenoxy)-N-[[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]propanamide
CID 3684614
N-[[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]quinoline-2-carboxamide
CID 3438844

Frequently Asked Questions

What is the IUPAC name of [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine?
The IUPAC name of [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine (CID 168530074) is [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine.
What is the SMILES notation for [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine?
The canonical SMILES for [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine is NN=Cc1ccccc1OCc1cccc(Br)c1.
What is the InChIKey of [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine?
The InChIKey is YERFAJWGVPUSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O/c15-13-6-3-4-11(8-13)10-18-14-7-2-1-5-12(14)9-17-16/h1-9H,10,16H2.
What are the key properties of [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine?
[2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine has a molecular weight of 305.18 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-bromophenyl)methoxy]phenyl]methylidenehydrazine is sourced from PubChem (CID 168530074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).