[(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine

C13H23ClN4 — CID 105201958

IUPAC[(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine
SMILESCC(C)n1ncc(Cl)c1C(NN)C1CCCCC1
InChIInChI=1S/C13H23ClN4/c1-9(2)18-13(11(14)8-16-18)12(17-15)10-6-4-3-5-7-10/h8-10,12,17H,3-7,15H2,1-2H3
InChIKeyZJQDBKYVVBRREG-UHFFFAOYSA-N
MW270.81 g/mol
LogP3.20
Rot. Bonds4

About [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine

[(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine (PubChem CID 105201958) has the molecular formula C13H23ClN4 and a molecular weight of 270.81 g/mol. Its IUPAC name is [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine
PubChem CID105201958
Molecular FormulaC13H23ClN4
Molecular Weight270.81 g/mol
Exact Mass270.16
IUPAC Name[(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine
SMILESCC(C)n1ncc(Cl)c1C(NN)C1CCCCC1
InChIInChI=1S/C13H23ClN4/c1-9(2)18-13(11(14)8-16-18)12(17-15)10-6-4-3-5-7-10/h8-10,12,17H,3-7,15H2,1-2H3
InChIKeyZJQDBKYVVBRREG-UHFFFAOYSA-N
XLogP3.20
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.81
LogP ≤ 53.20
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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Related Compounds

[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(thiolan-2-yl)methyl]hydrazine
CID 105255597
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 114655530
[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-cyclopentylmethyl]hydrazine
CID 105204303
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 105336884
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine
CID 105234528
7-bicyclo[4.1.0]heptanyl-(4-chloro-1-propan-2-ylpyrazol-5-yl)methanamine
CID 105041966
[3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl-(4-chloro-1-propan-2-ylpyrazol-5-yl)methyl]hydrazine
CID 105245184
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2-cyclopentyl-N-ethylethanamine
CID 105041674
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]hydrazine
CID 105248212
1-[(4-chloro-1-propan-2-ylpyrazol-5-yl)-hydrazinylmethyl]-N,N-dimethylcyclohexan-1-amine
CID 105243362
(4-tert-butylcyclohexyl)-(4-chloro-1-propan-2-ylpyrazol-5-yl)methanamine
CID 114655573
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(1-methylcyclopentyl)methyl]hydrazine
CID 105336781

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine?
The IUPAC name of [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine (CID 105201958) is [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine?
The canonical SMILES for [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine is CC(C)n1ncc(Cl)c1C(NN)C1CCCCC1.
What is the InChIKey of [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine?
The InChIKey is ZJQDBKYVVBRREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23ClN4/c1-9(2)18-13(11(14)8-16-18)12(17-15)10-6-4-3-5-7-10/h8-10,12,17H,3-7,15H2,1-2H3.
What are the key properties of [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine?
[(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine has a molecular weight of 270.81 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-propan-2-ylpyrazol-5-yl)-cyclohexylmethyl]hydrazine is sourced from PubChem (CID 105201958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).