[(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine

C16H25BrN2 — CID 114024320

IUPAC[(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
SMILESCCC1CCC(C(NN)c2cccc(C)c2Br)CC1
InChIInChI=1S/C16H25BrN2/c1-3-12-7-9-13(10-8-12)16(19-18)14-6-4-5-11(2)15(14)17/h4-6,12-13,16,19H,3,7-10,18H2,1-2H3
InChIKeyIOBLVGUSBHQGLD-UHFFFAOYSA-N
MW325.29 g/mol
LogP4.48
Rot. Bonds4

About [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine

[(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine (PubChem CID 114024320) has the molecular formula C16H25BrN2 and a molecular weight of 325.29 g/mol. Its IUPAC name is [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
PubChem CID114024320
Molecular FormulaC16H25BrN2
Molecular Weight325.29 g/mol
Exact Mass324.12
IUPAC Name[(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
SMILESCCC1CCC(C(NN)c2cccc(C)c2Br)CC1
InChIInChI=1S/C16H25BrN2/c1-3-12-7-9-13(10-8-12)16(19-18)14-6-4-5-11(2)15(14)17/h4-6,12-13,16,19H,3,7-10,18H2,1-2H3
InChIKeyIOBLVGUSBHQGLD-UHFFFAOYSA-N
XLogP4.48
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.29
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-ethylcyclohexyl)-(2-methyl-3-pyridinyl)methyl]hydrazine
CID 105313063
[(2-bromo-3-methylphenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 107986073
N-[(2-bromo-3-methylphenyl)-(3-ethylcyclohexyl)methyl]ethanamine
CID 107985076
[(2-bromo-3-fluorophenyl)-cyclopropylmethyl]hydrazine
CID 105314529
[(3-bromo-2-pyridinyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105268082
[(3-ethylcyclohexyl)-(2-methylphenyl)methyl]hydrazine
CID 105200437
[(2,3-dichlorophenyl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232276
[(3-ethylcyclopentyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105233566
(2-bromo-3-methylphenyl)-(3-ethylcyclohexyl)methanol
CID 107985730
[(4-ethylcyclohexyl)-thiophen-2-ylmethyl]hydrazine
CID 105193634
[(4-ethylcyclohexyl)-(3-iodophenyl)methyl]hydrazine
CID 105313007
[(5-chlorofuran-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 106694480

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine (CID 114024320) is [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine is CCC1CCC(C(NN)c2cccc(C)c2Br)CC1.
What is the InChIKey of [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine?
The InChIKey is IOBLVGUSBHQGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25BrN2/c1-3-12-7-9-13(10-8-12)16(19-18)14-6-4-5-11(2)15(14)17/h4-6,12-13,16,19H,3,7-10,18H2,1-2H3.
What are the key properties of [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine?
[(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine has a molecular weight of 325.29 g/mol, XLogP of 4.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-3-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 114024320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).