ethane;isoquinolin-1-ylhydrazine

C11H15N3 — CID 142316933

IUPACethane;isoquinolin-1-ylhydrazine
SMILESCC.NNc1nccc2ccccc12
InChIInChI=1S/C9H9N3.C2H6/c10-12-9-8-4-2-1-3-7(8)5-6-11-9;1-2/h1-6H,10H2,(H,11,12);1-2H3
InChIKeyAMUXELRITKTJLV-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.55
Rot. Bonds1

About ethane;isoquinolin-1-ylhydrazine

ethane;isoquinolin-1-ylhydrazine (PubChem CID 142316933) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is ethane;isoquinolin-1-ylhydrazine.

Molecular Properties

Compound Nameethane;isoquinolin-1-ylhydrazine
PubChem CID142316933
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Nameethane;isoquinolin-1-ylhydrazine
SMILESCC.NNc1nccc2ccccc12
InChIInChI=1S/C9H9N3.C2H6/c10-12-9-8-4-2-1-3-7(8)5-6-11-9;1-2/h1-6H,10H2,(H,11,12);1-2H3
InChIKeyAMUXELRITKTJLV-UHFFFAOYSA-N
XLogP2.55
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.55
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'}

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Related Compounds

N-tert-butylisoquinolin-1-amine;hydrate
CID 51057763
N-phenylisoquinolin-1-amine
CID 613037
N-phenylisoquinolin-1-amine;dihydrate
CID 51057780
N-naphthalen-1-ylisoquinolin-1-amine
CID 3677376
N-(4-methylphenyl)isoquinolin-1-amine
CID 3248179
ethane;isoquinolin-1-ylmethanamine
CID 145267324
N-(4-methylphenyl)isoquinolin-1-amine;dihydrate
CID 51057775
(6-bromoisoquinolin-1-yl)hydrazine
CID 82062983
3-N-isoquinolin-1-yl-3-methylpentane-1,3-diamine
CID 106166124
N-isoquinolin-1-yl-2,2-dimethylpropanamide
CID 598735
(3-ethylisoquinolin-1-yl)hydrazine
CID 153410703
4-N-isoquinolin-1-ylpyrimidine-4,6-diamine
CID 117086445

Frequently Asked Questions

What is the IUPAC name of ethane;isoquinolin-1-ylhydrazine?
The IUPAC name of ethane;isoquinolin-1-ylhydrazine (CID 142316933) is ethane;isoquinolin-1-ylhydrazine.
What is the SMILES notation for ethane;isoquinolin-1-ylhydrazine?
The canonical SMILES for ethane;isoquinolin-1-ylhydrazine is CC.NNc1nccc2ccccc12.
What is the InChIKey of ethane;isoquinolin-1-ylhydrazine?
The InChIKey is AMUXELRITKTJLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3.C2H6/c10-12-9-8-4-2-1-3-7(8)5-6-11-9;1-2/h1-6H,10H2,(H,11,12);1-2H3.
What are the key properties of ethane;isoquinolin-1-ylhydrazine?
ethane;isoquinolin-1-ylhydrazine has a molecular weight of 189.26 g/mol, XLogP of 2.55, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;isoquinolin-1-ylhydrazine is sourced from PubChem (CID 142316933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).