(1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine

C15H21N3 — CID 105303126

IUPAC(1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine
SMILESCCC(C)(C)C(NN)c1cccc2cnccc12
InChIInChI=1S/C15H21N3/c1-4-15(2,3)14(18-16)13-7-5-6-11-10-17-9-8-12(11)13/h5-10,14,18H,4,16H2,1-3H3
InChIKeyUTLRKKCRCPYJMT-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.18
Rot. Bonds4

About (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine

(1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine (PubChem CID 105303126) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine.

Molecular Properties

Compound Name(1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine
PubChem CID105303126
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name(1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine
SMILESCCC(C)(C)C(NN)c1cccc2cnccc12
InChIInChI=1S/C15H21N3/c1-4-15(2,3)14(18-16)13-7-5-6-11-10-17-9-8-12(11)13/h5-10,14,18H,4,16H2,1-3H3
InChIKeyUTLRKKCRCPYJMT-UHFFFAOYSA-N
XLogP3.18
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.18
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

(1S)-1-isoquinolin-5-ylpropan-1-amine
CID 55253697
(1-isoquinolin-5-yl-2-methylbutyl)hydrazine
CID 105219729
N,N-diethyl-1-hydrazinyl-1-isoquinolin-8-yl-2-methylpropan-2-amine
CID 103140329
(2-ethoxy-2-ethyl-1-isoquinolin-8-ylbutyl)hydrazine
CID 103140666
[isoquinolin-5-yl-(2-methoxyphenyl)methyl]hydrazine
CID 105191223
(1-isoquinolin-5-yl-2-methylsulfanylethyl)hydrazine
CID 105213991
1-isoquinolin-5-yl-2-propylsulfanylethanamine
CID 65128548
[(2-chloro-3-methylphenyl)-isoquinolin-5-ylmethyl]hydrazine
CID 105303099
2-amino-2-isoquinolin-5-ylethanol
CID 55271452
1-isoquinolin-5-yl-2-methylbutan-1-amine
CID 63719434
(1-isoquinolin-5-yl-2-methoxypropyl)hydrazine
CID 105247037
[2,2-dimethyl-1-(2-methylphenyl)butyl]hydrazine
CID 105286147

Frequently Asked Questions

What is the IUPAC name of (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine?
The IUPAC name of (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine (CID 105303126) is (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine.
What is the SMILES notation for (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine?
The canonical SMILES for (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine is CCC(C)(C)C(NN)c1cccc2cnccc12.
What is the InChIKey of (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine?
The InChIKey is UTLRKKCRCPYJMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-4-15(2,3)14(18-16)13-7-5-6-11-10-17-9-8-12(11)13/h5-10,14,18H,4,16H2,1-3H3.
What are the key properties of (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine?
(1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine has a molecular weight of 243.35 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-isoquinolin-5-yl-2,2-dimethylbutyl)hydrazine is sourced from PubChem (CID 105303126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).