[isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine

C14H17N3 — CID 105234888

IUPAC[isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine
SMILESCC1CC1C(NN)c1cncc2ccccc12
InChIInChI=1S/C14H17N3/c1-9-6-12(9)14(17-15)13-8-16-7-10-4-2-3-5-11(10)13/h2-5,7-9,12,14,17H,6,15H2,1H3
InChIKeySLEBFAYWVNBISX-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.40
Rot. Bonds3

About [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine

[isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine (PubChem CID 105234888) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine.

Molecular Properties

Compound Name[isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine
PubChem CID105234888
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name[isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine
SMILESCC1CC1C(NN)c1cncc2ccccc12
InChIInChI=1S/C14H17N3/c1-9-6-12(9)14(17-15)13-8-16-7-10-4-2-3-5-11(10)13/h2-5,7-9,12,14,17H,6,15H2,1H3
InChIKeySLEBFAYWVNBISX-UHFFFAOYSA-N
XLogP2.40
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.40
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 [isoquinolin-4-yl-(2-methylcyclopropyl)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-(2,2,3,3-tetramethylcyclopropyl)methyl]hydrazine
CID 105306448
[cyclohexyl(isoquinolin-4-yl)methyl]hydrazine
CID 105201816
[isoquinolin-4-yl(thian-2-yl)methyl]hydrazine
CID 105255789
(1-isoquinolin-4-yl-2-methylsulfanylethyl)hydrazine
CID 105213889
(2-ethyl-1-isoquinolin-4-ylbutyl)hydrazine
CID 105306338
1-(3-ethylcyclopentyl)-1-isoquinolin-4-yl-N-methylmethanamine
CID 65411220
1-(5,6-dimethyl-1,4-dithian-2-yl)-1-isoquinolin-4-yl-N-methylmethanamine
CID 103345994
(3,5-dimethylcyclohexyl)-isoquinolin-4-ylmethanol
CID 104504589
[isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine
CID 105306415
cyclopropyl(isoquinolin-4-yl)methanamine
CID 63939976
isoquinolin-4-yl-(3-methylcyclohexyl)methanamine
CID 63938819
N-[isoquinolin-4-yl-(3-methyloxolan-2-yl)methyl]propan-1-amine
CID 115856200

Frequently Asked Questions

What is the IUPAC name of [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine?
The IUPAC name of [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine (CID 105234888) is [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine.
What is the SMILES notation for [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine?
The canonical SMILES for [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine is CC1CC1C(NN)c1cncc2ccccc12.
What is the InChIKey of [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine?
The InChIKey is SLEBFAYWVNBISX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-9-6-12(9)14(17-15)13-8-16-7-10-4-2-3-5-11(10)13/h2-5,7-9,12,14,17H,6,15H2,1H3.
What are the key properties of [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine?
[isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine has a molecular weight of 227.31 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [isoquinolin-4-yl-(2-methylcyclopropyl)methyl]hydrazine is sourced from PubChem (CID 105234888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).