[(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine

C16H25ClN2O2 — CID 105204608

IUPAC[(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine
SMILESCOc1cc(C(NN)C2CCC(C)CC2)cc(Cl)c1OC
InChIInChI=1S/C16H25ClN2O2/c1-10-4-6-11(7-5-10)15(19-18)12-8-13(17)16(21-3)14(9-12)20-2/h8-11,15,19H,4-7,18H2,1-3H3
InChIKeyOCZKNCMNTCTDJC-UHFFFAOYSA-N
MW312.84 g/mol
LogP3.69
Rot. Bonds5

About [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine

[(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine (PubChem CID 105204608) has the molecular formula C16H25ClN2O2 and a molecular weight of 312.84 g/mol. Its IUPAC name is [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine
PubChem CID105204608
Molecular FormulaC16H25ClN2O2
Molecular Weight312.84 g/mol
Exact Mass312.16
IUPAC Name[(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine
SMILESCOc1cc(C(NN)C2CCC(C)CC2)cc(Cl)c1OC
InChIInChI=1S/C16H25ClN2O2/c1-10-4-6-11(7-5-10)15(19-18)12-8-13(17)16(21-3)14(9-12)20-2/h8-11,15,19H,4-7,18H2,1-3H3
InChIKeyOCZKNCMNTCTDJC-UHFFFAOYSA-N
XLogP3.69
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.84
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[1-(3-chloro-4,5-dimethoxyphenyl)-2-cyclopropylethyl]hydrazine
CID 105204535
[(2-methoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105191189
[cyclopropyl-(3-methoxy-4-methylphenyl)methyl]hydrazine
CID 105314485
[1-(3-chloro-4,5-dimethoxyphenyl)-2,2-dimethylpropyl]hydrazine
CID 105204625
[(2,4-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105210736
[(3-methoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105191732
(3-chloro-4,5-dimethoxyphenyl)-cyclopentylmethanol
CID 54878443
1-(3-chloro-4,5-dimethoxyphenyl)-2-cyclopropyl-N-methylethanamine
CID 64906585
[(3-chloro-4,5-dimethoxyphenyl)-(4-methylphenyl)methyl]hydrazine
CID 105204556
(3-chloro-4,5-dimethoxyphenyl)-cycloheptylmethanol
CID 82931298
1-(3-chloro-4,5-dimethoxyphenyl)hexylhydrazine
CID 105204626
[(4-chloro-3-methoxyphenyl)-(thiolan-3-yl)methyl]hydrazine
CID 105320870

Frequently Asked Questions

What is the IUPAC name of [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine (CID 105204608) is [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine is COc1cc(C(NN)C2CCC(C)CC2)cc(Cl)c1OC.
What is the InChIKey of [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine?
The InChIKey is OCZKNCMNTCTDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25ClN2O2/c1-10-4-6-11(7-5-10)15(19-18)12-8-13(17)16(21-3)14(9-12)20-2/h8-11,15,19H,4-7,18H2,1-3H3.
What are the key properties of [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine?
[(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine has a molecular weight of 312.84 g/mol, XLogP of 3.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-4,5-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105204608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).