[(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine

C17H19BrN2O — CID 105341051

IUPAC[(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine
SMILESCc1ccc(Br)c(C(NN)c2ccc(OC3CC3)cc2)c1
InChIInChI=1S/C17H19BrN2O/c1-11-2-9-16(18)15(10-11)17(20-19)12-3-5-13(6-4-12)21-14-7-8-14/h2-6,9-10,14,17,20H,7-8,19H2,1H3
InChIKeyOBMFGSXLNHRJLL-UHFFFAOYSA-N
MW347.26 g/mol
LogP3.85
Rot. Bonds5

About [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine

[(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine (PubChem CID 105341051) has the molecular formula C17H19BrN2O and a molecular weight of 347.26 g/mol. Its IUPAC name is [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine
PubChem CID105341051
Molecular FormulaC17H19BrN2O
Molecular Weight347.26 g/mol
Exact Mass346.07
IUPAC Name[(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine
SMILESCc1ccc(Br)c(C(NN)c2ccc(OC3CC3)cc2)c1
InChIInChI=1S/C17H19BrN2O/c1-11-2-9-16(18)15(10-11)17(20-19)12-3-5-13(6-4-12)21-14-7-8-14/h2-6,9-10,14,17,20H,7-8,19H2,1H3
InChIKeyOBMFGSXLNHRJLL-UHFFFAOYSA-N
XLogP3.85
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.26
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[(4-cyclopropyloxyphenyl)-(2,5-dibromophenyl)methyl]hydrazine
CID 105341009
[(4-cyclopropyloxyphenyl)-(4-methylphenyl)methyl]hydrazine
CID 105194287
[(4-bromo-3-chlorophenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine
CID 105341008
[(4-cyclopropyloxyphenyl)-(3,5-dibromophenyl)methyl]hydrazine
CID 107979462
[(3-cyclopropyloxyphenyl)-(2,5-dimethylphenyl)methyl]hydrazine
CID 105341115
[(4-chloro-3-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine
CID 105340975
(2-bromo-4-methylphenyl)-(4-cyclopropyloxyphenyl)methanol
CID 114518704
[(2,5-dibromophenyl)-(4-ethoxyphenyl)methyl]hydrazine
CID 105300739
[(2-bromo-5-methylphenyl)-(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine
CID 105301067
[(2-bromo-5-methylphenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105330014
[(2-bromo-4-methylphenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105304109
[(3-bromo-2-pyridinyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine
CID 105268015

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine (CID 105341051) is [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine is Cc1ccc(Br)c(C(NN)c2ccc(OC3CC3)cc2)c1.
What is the InChIKey of [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine?
The InChIKey is OBMFGSXLNHRJLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19BrN2O/c1-11-2-9-16(18)15(10-11)17(20-19)12-3-5-13(6-4-12)21-14-7-8-14/h2-6,9-10,14,17,20H,7-8,19H2,1H3.
What are the key properties of [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine?
[(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine has a molecular weight of 347.26 g/mol, XLogP of 3.85, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-5-methylphenyl)-(4-cyclopropyloxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105341051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).