[3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine

C14H23N3O — CID 114342247

IUPAC[3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine
SMILESCC1(C)CCC(OCc2cccnc2NN)CC1
InChIInChI=1S/C14H23N3O/c1-14(2)7-5-12(6-8-14)18-10-11-4-3-9-16-13(11)17-15/h3-4,9,12H,5-8,10,15H2,1-2H3,(H,16,17)
InChIKeyGETAYHAWMMKFAH-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.85
Rot. Bonds4

About [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine

[3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine (PubChem CID 114342247) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine
PubChem CID114342247
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name[3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine
SMILESCC1(C)CCC(OCc2cccnc2NN)CC1
InChIInChI=1S/C14H23N3O/c1-14(2)7-5-12(6-8-14)18-10-11-4-3-9-16-13(11)17-15/h3-4,9,12H,5-8,10,15H2,1-2H3,(H,16,17)
InChIKeyGETAYHAWMMKFAH-UHFFFAOYSA-N
XLogP2.85
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.85
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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Frequently Asked Questions

What is the IUPAC name of [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine?
The IUPAC name of [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine (CID 114342247) is [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine is CC1(C)CCC(OCc2cccnc2NN)CC1.
What is the InChIKey of [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine?
The InChIKey is GETAYHAWMMKFAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-14(2)7-5-12(6-8-14)18-10-11-4-3-9-16-13(11)17-15/h3-4,9,12H,5-8,10,15H2,1-2H3,(H,16,17).
What are the key properties of [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine?
[3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine has a molecular weight of 249.36 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 114342247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).