[2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine

C14H21N3O — CID 105270168

IUPAC[2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine
SMILESCOc1cncc(C(CC2=CCCCC2)NN)c1
InChIInChI=1S/C14H21N3O/c1-18-13-8-12(9-16-10-13)14(17-15)7-11-5-3-2-4-6-11/h5,8-10,14,17H,2-4,6-7,15H2,1H3
InChIKeyXHIRWNVYIJCIRS-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.49
Rot. Bonds5

About [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine

[2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine (PubChem CID 105270168) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine
PubChem CID105270168
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name[2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine
SMILESCOc1cncc(C(CC2=CCCCC2)NN)c1
InChIInChI=1S/C14H21N3O/c1-18-13-8-12(9-16-10-13)14(17-15)7-11-5-3-2-4-6-11/h5,8-10,14,17H,2-4,6-7,15H2,1H3
InChIKeyXHIRWNVYIJCIRS-UHFFFAOYSA-N
XLogP2.49
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-(cyclohexen-1-yl)-N-methyl-1-(5-propan-2-yloxy-3-pyridinyl)ethanamine
CID 116661576
[1-(5-methoxy-3-pyridinyl)-2-(3-methylphenyl)ethyl]hydrazine
CID 105209069
[2-(2,6-difluorophenyl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105329677
[2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 105270067
2-(cyclohexen-1-yl)-1-(5-propoxy-3-pyridinyl)ethanamine
CID 116661287
[1-(5-methoxy-3-pyridinyl)-2-pyridin-2-ylethyl]hydrazine
CID 105200033
[1-(5-methoxy-3-pyridinyl)-2-thiophen-2-ylethyl]hydrazine
CID 105212005
[2-(cyclohexen-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethyl]hydrazine
CID 105270064
[1-(5-methoxy-3-pyridinyl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]hydrazine
CID 105214806
[2-(cyclohexen-1-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethyl]hydrazine
CID 105270013
1-(5-methoxy-3-pyridinyl)heptylhydrazine
CID 105329844
[1-(5-methoxy-3-pyridinyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
CID 105329848

Frequently Asked Questions

What is the IUPAC name of [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine (CID 105270168) is [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine is COc1cncc(C(CC2=CCCCC2)NN)c1.
What is the InChIKey of [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine?
The InChIKey is XHIRWNVYIJCIRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-18-13-8-12(9-16-10-13)14(17-15)7-11-5-3-2-4-6-11/h5,8-10,14,17H,2-4,6-7,15H2,1H3.
What are the key properties of [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine?
[2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine has a molecular weight of 247.34 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105270168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).