[(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine

C16H23N5 — CID 105210469

IUPAC[(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
SMILESCC1CCCC(C(NN)c2cnnn2-c2ccccc2)C1
InChIInChI=1S/C16H23N5/c1-12-6-5-7-13(10-12)16(19-17)15-11-18-20-21(15)14-8-3-2-4-9-14/h2-4,8-9,11-13,16,19H,5-7,10,17H2,1H3
InChIKeyAUAOSUJGXLCKAT-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.60
Rot. Bonds4

About [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine

[(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine (PubChem CID 105210469) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
PubChem CID105210469
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name[(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
SMILESCC1CCCC(C(NN)c2cnnn2-c2ccccc2)C1
InChIInChI=1S/C16H23N5/c1-12-6-5-7-13(10-12)16(19-17)15-11-18-20-21(15)14-8-3-2-4-9-14/h2-4,8-9,11-13,16,19H,5-7,10,17H2,1H3
InChIKeyAUAOSUJGXLCKAT-UHFFFAOYSA-N
XLogP2.60
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[(2-methylcyclopentyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
CID 107194806
[(2-ethoxyphenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 105210206
3-[hydrazinyl-(3-methylcyclohexyl)methyl]pyridin-4-amine
CID 105210283
cyclopropyl-(3-phenyltriazol-4-yl)methanamine
CID 114687020
4-[hydrazinyl-(3-methylcyclohexyl)methyl]-1H-pyrazol-5-amine
CID 105231091
N-methyl-1-(3-methylcyclohexyl)-1-pyrazolo[1,5-a]pyridin-3-ylmethanamine
CID 103127395
[(2-fluoro-3-methylphenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 105313617
[(1-methylcyclopentyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
CID 105337414
N-methyl-1-(5-methyloxolan-2-yl)-1-(3-phenyltriazol-4-yl)methanamine
CID 105043162
[cyclooctyl-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105255052
[(3-methylcyclohexyl)-(4-methylphenyl)methyl]hydrazine
CID 105194279
[(1-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine
CID 106831373

Frequently Asked Questions

What is the IUPAC name of [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine?
The IUPAC name of [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine (CID 105210469) is [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine is CC1CCCC(C(NN)c2cnnn2-c2ccccc2)C1.
What is the InChIKey of [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine?
The InChIKey is AUAOSUJGXLCKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-12-6-5-7-13(10-12)16(19-17)15-11-18-20-21(15)14-8-3-2-4-9-14/h2-4,8-9,11-13,16,19H,5-7,10,17H2,1H3.
What are the key properties of [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine?
[(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine has a molecular weight of 285.39 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-methylcyclohexyl)-(3-phenyltriazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105210469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).