[(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine

C14H22FN3O — CID 105277528

IUPAC[(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine
SMILESCOC1(C(NN)c2ccncc2F)CCCC(C)C1
InChIInChI=1S/C14H22FN3O/c1-10-4-3-6-14(8-10,19-2)13(18-16)11-5-7-17-9-12(11)15/h5,7,9-10,13,18H,3-4,6,8,16H2,1-2H3
InChIKeyCNERZPLHWYAPHV-UHFFFAOYSA-N
MW267.35 g/mol
LogP2.32
Rot. Bonds4

About [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine

[(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine (PubChem CID 105277528) has the molecular formula C14H22FN3O and a molecular weight of 267.35 g/mol. Its IUPAC name is [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine
PubChem CID105277528
Molecular FormulaC14H22FN3O
Molecular Weight267.35 g/mol
Exact Mass267.17
IUPAC Name[(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine
SMILESCOC1(C(NN)c2ccncc2F)CCCC(C)C1
InChIInChI=1S/C14H22FN3O/c1-10-4-3-6-14(8-10,19-2)13(18-16)11-5-7-17-9-12(11)15/h5,7,9-10,13,18H,3-4,6,8,16H2,1-2H3
InChIKeyCNERZPLHWYAPHV-UHFFFAOYSA-N
XLogP2.32
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 52.32
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-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine (CID 105277528) is [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine is COC1(C(NN)c2ccncc2F)CCCC(C)C1.
What is the InChIKey of [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine?
The InChIKey is CNERZPLHWYAPHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22FN3O/c1-10-4-3-6-14(8-10,19-2)13(18-16)11-5-7-17-9-12(11)15/h5,7,9-10,13,18H,3-4,6,8,16H2,1-2H3.
What are the key properties of [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine?
[(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine has a molecular weight of 267.35 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-fluoro-4-pyridinyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105277528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).