[1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine

C12H21N3O — CID 105262232

IUPAC[1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine
SMILESCCc1cnccc1C(CCCOC)NN
InChIInChI=1S/C12H21N3O/c1-3-10-9-14-7-6-11(10)12(15-13)5-4-8-16-2/h6-7,9,12,15H,3-5,8,13H2,1-2H3
InChIKeyWPTNXWCGJCLLLZ-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.58
Rot. Bonds7

About [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine

[1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine (PubChem CID 105262232) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine
PubChem CID105262232
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name[1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine
SMILESCCc1cnccc1C(CCCOC)NN
InChIInChI=1S/C12H21N3O/c1-3-10-9-14-7-6-11(10)12(15-13)5-4-8-16-2/h6-7,9,12,15H,3-5,8,13H2,1-2H3
InChIKeyWPTNXWCGJCLLLZ-UHFFFAOYSA-N
XLogP1.58
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.58
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

N-ethyl-1-(3-ethyl-4-pyridinyl)-4-methoxybutan-1-amine
CID 114856842
[1-(3-ethyl-4-pyridinyl)-2-methoxyethyl]hydrazine
CID 105262260
[1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine
CID 105262044
[1-(3-ethyl-4-pyridinyl)-2-propoxyethyl]hydrazine
CID 105262063
[4-methoxy-1-[4-(trifluoromethyl)-3-pyridinyl]butyl]hydrazine
CID 102710333
(4-methoxy-1-pyridin-3-ylbutyl)hydrazine
CID 105196232
[3-methoxy-1-(4-methyl-3-pyridinyl)propyl]hydrazine
CID 105206412
[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine
CID 105335371
1-(3-fluoro-4-pyridinyl)-4-methoxy-N-propylbutan-1-amine
CID 113447246
[1-(3-ethyl-4-pyridinyl)-2-(1,3-thiazol-5-yl)ethyl]hydrazine
CID 105262110
1-(3-methyl-4-pyridinyl)pentylhydrazine
CID 105261719
[1-(3-fluoro-4-pyridinyl)-3-(2-methoxyethoxy)propyl]hydrazine
CID 102930056

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine?
The IUPAC name of [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine (CID 105262232) is [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine.
What is the SMILES notation for [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine?
The canonical SMILES for [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine is CCc1cnccc1C(CCCOC)NN.
What is the InChIKey of [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine?
The InChIKey is WPTNXWCGJCLLLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-3-10-9-14-7-6-11(10)12(15-13)5-4-8-16-2/h6-7,9,12,15H,3-5,8,13H2,1-2H3.
What are the key properties of [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine?
[1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine has a molecular weight of 223.32 g/mol, XLogP of 1.58, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine is sourced from PubChem (CID 105262232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).