[cyclohexyl(isoquinolin-4-yl)methyl]hydrazine

C16H21N3 — CID 105201816

IUPAC[cyclohexyl(isoquinolin-4-yl)methyl]hydrazine
SMILESNNC(c1cncc2ccccc12)C1CCCCC1
InChIInChI=1S/C16H21N3/c17-19-16(12-6-2-1-3-7-12)15-11-18-10-13-8-4-5-9-14(13)15/h4-5,8-12,16,19H,1-3,6-7,17H2
InChIKeyBHFBLXLRMADMNC-UHFFFAOYSA-N
MW255.37 g/mol
LogP3.32
Rot. Bonds3

About [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine

[cyclohexyl(isoquinolin-4-yl)methyl]hydrazine (PubChem CID 105201816) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclohexyl(isoquinolin-4-yl)methyl]hydrazine
PubChem CID105201816
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name[cyclohexyl(isoquinolin-4-yl)methyl]hydrazine
SMILESNNC(c1cncc2ccccc12)C1CCCCC1
InChIInChI=1S/C16H21N3/c17-19-16(12-6-2-1-3-7-12)15-11-18-10-13-8-4-5-9-14(13)15/h4-5,8-12,16,19H,1-3,6-7,17H2
InChIKeyBHFBLXLRMADMNC-UHFFFAOYSA-N
XLogP3.32
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[isoquinolin-4-yl(thian-2-yl)methyl]hydrazine
CID 105255789
[isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine
CID 105234888
2-cycloheptyl-1-isoquinolin-4-ylethanol
CID 115798049
[isoquinolin-4-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]hydrazine
CID 105306448
cyclopropyl(isoquinolin-4-yl)methanamine
CID 63939976
[1-benzofuran-3-yl(cyclohexyl)methyl]hydrazine
CID 105262439
3-cyclopentyl-1-isoquinolin-4-ylpropan-1-amine
CID 115856292
[1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine
CID 105282068
[cyclooctyl-(2-methylphenyl)methyl]hydrazine
CID 105254975
isoquinolin-4-yl(oxan-3-yl)methanamine
CID 65331748
2-cyclohexylsulfanyl-1-isoquinolin-4-ylethanamine
CID 65139951
isoquinolin-4-yl-(3-methylcyclohexyl)methanamine
CID 63938819

Frequently Asked Questions

What is the IUPAC name of [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine?
The IUPAC name of [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine (CID 105201816) is [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine.
What is the SMILES notation for [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine?
The canonical SMILES for [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine is NNC(c1cncc2ccccc12)C1CCCCC1.
What is the InChIKey of [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine?
The InChIKey is BHFBLXLRMADMNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c17-19-16(12-6-2-1-3-7-12)15-11-18-10-13-8-4-5-9-14(13)15/h4-5,8-12,16,19H,1-3,6-7,17H2.
What are the key properties of [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine?
[cyclohexyl(isoquinolin-4-yl)methyl]hydrazine has a molecular weight of 255.37 g/mol, XLogP of 3.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohexyl(isoquinolin-4-yl)methyl]hydrazine is sourced from PubChem (CID 105201816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).