[1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine

C16H24N2O — CID 106650430

IUPAC[1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine
SMILESCc1cccc(OCCC(NN)C2=CCCCC2)c1
InChIInChI=1S/C16H24N2O/c1-13-6-5-9-15(12-13)19-11-10-16(18-17)14-7-3-2-4-8-14/h5-7,9,12,16,18H,2-4,8,10-11,17H2,1H3
InChIKeyXIACSMUGPXVADM-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.10
Rot. Bonds6

About [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine

[1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine (PubChem CID 106650430) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine
PubChem CID106650430
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name[1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine
SMILESCc1cccc(OCCC(NN)C2=CCCCC2)c1
InChIInChI=1S/C16H24N2O/c1-13-6-5-9-15(12-13)19-11-10-16(18-17)14-7-3-2-4-8-14/h5-7,9,12,16,18H,2-4,8,10-11,17H2,1H3
InChIKeyXIACSMUGPXVADM-UHFFFAOYSA-N
XLogP3.10
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[1-[(1E)-cycloocten-1-yl]-3-(3-methylphenyl)propyl]hydrazine
CID 106650129
[3-(3-methylphenoxy)-1-phenylpropyl]hydrazine
CID 105283017
[1-(3-methylphenyl)-3-phenoxypropyl]hydrazine
CID 105191420
[1-(cycloocten-1-yl)-3-ethoxypropyl]hydrazine
CID 106650004
[1-(3-bromo-2-fluorophenyl)-3-(3-methylphenoxy)propyl]hydrazine
CID 106649751
[1-(cyclohexen-1-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 106648692
[6-methyl-1-(3-methylphenoxy)heptan-3-yl]hydrazine
CID 105294303
[1-(cyclohepten-1-yl)-4-methoxybutyl]hydrazine
CID 106648972
[4-(3-methylphenoxy)-1-phenylbutan-2-yl]hydrazine
CID 105283208
1-(3-methylphenoxy)hex-5-yn-3-ylhydrazine
CID 105281608
[5-methyl-1-(3-methylphenoxy)heptan-3-yl]hydrazine
CID 105298656
1-(cyclohexen-1-yl)-N-methyl-2-(3-methylphenyl)sulfanylethanamine
CID 106653438

Frequently Asked Questions

What is the IUPAC name of [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine?
The IUPAC name of [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine (CID 106650430) is [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine.
What is the SMILES notation for [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine?
The canonical SMILES for [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine is Cc1cccc(OCCC(NN)C2=CCCCC2)c1.
What is the InChIKey of [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine?
The InChIKey is XIACSMUGPXVADM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13-6-5-9-15(12-13)19-11-10-16(18-17)14-7-3-2-4-8-14/h5-7,9,12,16,18H,2-4,8,10-11,17H2,1H3.
What are the key properties of [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine?
[1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine has a molecular weight of 260.38 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclohexen-1-yl)-3-(3-methylphenoxy)propyl]hydrazine is sourced from PubChem (CID 106650430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).