(3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine

C14H19N3O — CID 103141619

IUPAC(3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine
SMILESCCOCCC(NN)c1cccc2ccncc12
InChIInChI=1S/C14H19N3O/c1-2-18-9-7-14(17-15)12-5-3-4-11-6-8-16-10-13(11)12/h3-6,8,10,14,17H,2,7,9,15H2,1H3
InChIKeyXEUFVURJULJWEA-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.17
Rot. Bonds6

About (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine

(3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine (PubChem CID 103141619) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine.

Molecular Properties

Compound Name(3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine
PubChem CID103141619
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name(3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine
SMILESCCOCCC(NN)c1cccc2ccncc12
InChIInChI=1S/C14H19N3O/c1-2-18-9-7-14(17-15)12-5-3-4-11-6-8-16-10-13(11)12/h3-6,8,10,14,17H,2,7,9,15H2,1H3
InChIKeyXEUFVURJULJWEA-UHFFFAOYSA-N
XLogP2.17
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(3-cyclohexyl-1-isoquinolin-8-ylpropyl)hydrazine
CID 103141698
[1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine
CID 105300605
1-isoquinolin-8-yl-N-methylbutan-1-amine
CID 103136371
4-ethoxy-N-ethyl-1-isoquinolin-5-ylbutan-1-amine
CID 105143482
1-isoquinolin-8-yl-N-methylpropan-1-amine
CID 103136782
(2-ethoxy-2-ethyl-1-isoquinolin-8-ylbutyl)hydrazine
CID 103140666
3-ethoxy-N-methyl-1-naphthalen-1-ylpropan-1-amine
CID 112688299
[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine
CID 105335371
4-ethoxy-1-isoquinolin-5-ylbutan-1-ol
CID 105094595
1-isoquinolin-8-yl-N-methylheptan-1-amine
CID 103137970
(1-isoquinolin-5-yl-3-pyridin-4-ylpropyl)hydrazine
CID 105303109
(1-isoquinolin-8-yl-2-thiophen-3-ylethyl)hydrazine
CID 103141500

Frequently Asked Questions

What is the IUPAC name of (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine?
The IUPAC name of (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine (CID 103141619) is (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine.
What is the SMILES notation for (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine?
The canonical SMILES for (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine is CCOCCC(NN)c1cccc2ccncc12.
What is the InChIKey of (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine?
The InChIKey is XEUFVURJULJWEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-2-18-9-7-14(17-15)12-5-3-4-11-6-8-16-10-13(11)12/h3-6,8,10,14,17H,2,7,9,15H2,1H3.
What are the key properties of (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine?
(3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine has a molecular weight of 245.33 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine is sourced from PubChem (CID 103141619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).