[2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine

C17H29N3O — CID 105273848

IUPAC[2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine
SMILESCCOC(C(NN)C1CCCc2cccnc21)C(C)(C)C
InChIInChI=1S/C17H29N3O/c1-5-21-16(17(2,3)4)15(20-18)13-10-6-8-12-9-7-11-19-14(12)13/h7,9,11,13,15-16,20H,5-6,8,10,18H2,1-4H3
InChIKeyNSLCALDSLDXMGO-UHFFFAOYSA-N
MW291.44 g/mol
LogP2.78
Rot. Bonds5

About [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine

[2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine (PubChem CID 105273848) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine.

Molecular Properties

Compound Name[2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine
PubChem CID105273848
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC Name[2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine
SMILESCCOC(C(NN)C1CCCc2cccnc21)C(C)(C)C
InChIInChI=1S/C17H29N3O/c1-5-21-16(17(2,3)4)15(20-18)13-10-6-8-12-9-7-11-19-14(12)13/h7,9,11,13,15-16,20H,5-6,8,10,18H2,1-4H3
InChIKeyNSLCALDSLDXMGO-UHFFFAOYSA-N
XLogP2.78
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[2,2-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propyl]hydrazine
CID 105203138
N,N-diethyl-1-hydrazinyl-2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-amine
CID 105239381
2-ethoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79747758
2-methoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-ol
CID 116713188
2-ethoxy-2-ethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 116759628
1-(5,6,7,8-tetrahydroquinolin-8-yl)hexylhydrazine
CID 105320905
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-diethoxy-N-ethylethanamine
CID 79748328
2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
CID 116718864
[cyclobutyl(5,6,7,8-tetrahydroquinolin-8-yl)methyl]hydrazine
CID 105224521
1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 79748417
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588
(8R)-8-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 58752937

Frequently Asked Questions

What is the IUPAC name of [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine?
The IUPAC name of [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine (CID 105273848) is [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine.
What is the SMILES notation for [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine?
The canonical SMILES for [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine is CCOC(C(NN)C1CCCc2cccnc21)C(C)(C)C.
What is the InChIKey of [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine?
The InChIKey is NSLCALDSLDXMGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-5-21-16(17(2,3)4)15(20-18)13-10-6-8-12-9-7-11-19-14(12)13/h7,9,11,13,15-16,20H,5-6,8,10,18H2,1-4H3.
What are the key properties of [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine?
[2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine has a molecular weight of 291.44 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butyl]hydrazine is sourced from PubChem (CID 105273848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).