[1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine

C18H30N2O — CID 105312494

IUPAC[1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine
SMILESCc1cccc(OCCC(NN)C2CCC(C)C(C)C2)c1
InChIInChI=1S/C18H30N2O/c1-13-5-4-6-17(11-13)21-10-9-18(20-19)16-8-7-14(2)15(3)12-16/h4-6,11,14-16,18,20H,7-10,12,19H2,1-3H3
InChIKeyYAKHABLXLQVCLI-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.67
Rot. Bonds6

About [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine

[1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine (PubChem CID 105312494) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine
PubChem CID105312494
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name[1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine
SMILESCc1cccc(OCCC(NN)C2CCC(C)C(C)C2)c1
InChIInChI=1S/C18H30N2O/c1-13-5-4-6-17(11-13)21-10-9-18(20-19)16-8-7-14(2)15(3)12-16/h4-6,11,14-16,18,20H,7-10,12,19H2,1-3H3
InChIKeyYAKHABLXLQVCLI-UHFFFAOYSA-N
XLogP3.67
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.67
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

[6-methyl-1-(3-methylphenoxy)heptan-3-yl]hydrazine
CID 105294303
2,5-dimethyl-N-[2-(3-methylphenoxy)ethyl]cyclohexan-1-amine
CID 64761505
1-(3-methylphenoxy)hex-5-yn-3-ylhydrazine
CID 105281608
[4-(3-methylphenoxy)-1-phenylbutan-2-yl]hydrazine
CID 105283208
1-cyclopropyl-N-[2-(3-methylphenoxy)ethyl]ethanamine
CID 60696154
[3-(3-methylphenoxy)-1-phenylpropyl]hydrazine
CID 105283017
[5-methyl-1-(3-methylphenoxy)heptan-3-yl]hydrazine
CID 105298656
[1-cyclohexyl-3-(3-methylphenyl)propyl]hydrazine
CID 105282141
[1-(3-ethylcyclohexyl)-3-(3-methylphenyl)propyl]hydrazine
CID 105313791
1-[(3,4-dimethylcyclohexyl)amino]-3-(3-methylphenoxy)propan-2-ol
CID 64741127
[1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine
CID 106650430
1-methoxy-N-methyl-4-(3-methylphenoxy)butan-2-amine
CID 105165685

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine?
The IUPAC name of [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine (CID 105312494) is [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine.
What is the SMILES notation for [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine?
The canonical SMILES for [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine is Cc1cccc(OCCC(NN)C2CCC(C)C(C)C2)c1.
What is the InChIKey of [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine?
The InChIKey is YAKHABLXLQVCLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-13-5-4-6-17(11-13)21-10-9-18(20-19)16-8-7-14(2)15(3)12-16/h4-6,11,14-16,18,20H,7-10,12,19H2,1-3H3.
What are the key properties of [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine?
[1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine has a molecular weight of 290.45 g/mol, XLogP of 3.67, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dimethylcyclohexyl)-3-(3-methylphenoxy)propyl]hydrazine is sourced from PubChem (CID 105312494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).