[(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine

C16H25ClN2O — CID 107193744

IUPAC[(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine
SMILESCOc1ccc(Cl)cc1C(NN)C1CCCCC1(C)C
InChIInChI=1S/C16H25ClN2O/c1-16(2)9-5-4-6-13(16)15(19-18)12-10-11(17)7-8-14(12)20-3/h7-8,10,13,15,19H,4-6,9,18H2,1-3H3
InChIKeyNIUSTJASPRGIJT-UHFFFAOYSA-N
MW296.84 g/mol
LogP4.07
Rot. Bonds4

About [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine

[(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine (PubChem CID 107193744) has the molecular formula C16H25ClN2O and a molecular weight of 296.84 g/mol. Its IUPAC name is [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine
PubChem CID107193744
Molecular FormulaC16H25ClN2O
Molecular Weight296.84 g/mol
Exact Mass296.17
IUPAC Name[(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine
SMILESCOc1ccc(Cl)cc1C(NN)C1CCCCC1(C)C
InChIInChI=1S/C16H25ClN2O/c1-16(2)9-5-4-6-13(16)15(19-18)12-10-11(17)7-8-14(12)20-3/h7-8,10,13,15,19H,4-6,9,18H2,1-3H3
InChIKeyNIUSTJASPRGIJT-UHFFFAOYSA-N
XLogP4.07
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.84
LogP ≤ 54.07
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

(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methanamine
CID 107178190
[(2,2-dimethylcyclopentyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 107194613
(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methanol
CID 107181861
[(2,2-dimethylcyclohexyl)-(2-fluorophenyl)methyl]hydrazine
CID 107193522
[(5-chloro-2-methoxyphenyl)-(1,1-dioxothian-2-yl)methyl]hydrazine
CID 105300920
[2-(5-chloro-2-methoxyphenyl)-1-(2,2-dimethylcyclopentyl)ethyl]hydrazine
CID 107193657
1-(2,2-dimethylcyclohexyl)-1-(5-fluoro-2-methoxyphenyl)-N-methylmethanamine
CID 107177273
[(5-chloro-2-methoxyphenyl)-(2-ethylcyclohexyl)methyl]hydrazine
CID 105309673
[(2,2-dimethylcyclopentyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 107193846
[(2-chloro-5-fluorophenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine
CID 107194986
2-(5-chloro-2-methoxyphenyl)-1-(2,2-dimethylcyclopentyl)-N-methylethanamine
CID 107188374
[(2,3-dichlorophenyl)-(2,2-dimethylcyclopentyl)methyl]hydrazine
CID 107193772

Frequently Asked Questions

What is the IUPAC name of [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine (CID 107193744) is [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine is COc1ccc(Cl)cc1C(NN)C1CCCCC1(C)C.
What is the InChIKey of [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine?
The InChIKey is NIUSTJASPRGIJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25ClN2O/c1-16(2)9-5-4-6-13(16)15(19-18)12-10-11(17)7-8-14(12)20-3/h7-8,10,13,15,19H,4-6,9,18H2,1-3H3.
What are the key properties of [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine?
[(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine has a molecular weight of 296.84 g/mol, XLogP of 4.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 107193744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).