[3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine

C12H21N3O2 — CID 106449351

IUPAC[3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine
SMILESCC(C)COCCOCc1cccnc1NN
InChIInChI=1S/C12H21N3O2/c1-10(2)8-16-6-7-17-9-11-4-3-5-14-12(11)15-13/h3-5,10H,6-9,13H2,1-2H3,(H,14,15)
InChIKeyKATULPRGSMCKQB-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.56
Rot. Bonds8

About [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine

[3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine (PubChem CID 106449351) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine
PubChem CID106449351
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name[3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine
SMILESCC(C)COCCOCc1cccnc1NN
InChIInChI=1S/C12H21N3O2/c1-10(2)8-16-6-7-17-9-11-4-3-5-14-12(11)15-13/h3-5,10H,6-9,13H2,1-2H3,(H,14,15)
InChIKeyKATULPRGSMCKQB-UHFFFAOYSA-N
XLogP1.56
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-[2-(2-methylpropoxy)ethoxymethyl]pyridine-2-carbonitrile
CID 106447603
3-[2-(2-methylpropoxy)ethyl]pyridin-2-amine
CID 106458112
3-(chloromethyl)-2-[2-(2-methylpropoxy)ethoxy]pyridine
CID 106448463
[3-(thiophen-2-ylmethoxymethyl)-2-pyridinyl]hydrazine
CID 62464119
[3-(propan-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine
CID 62464001
3-fluoro-N-[2-(2-methylpropoxy)ethyl]pyridin-2-amine
CID 115684649
[3-[(4,4-dimethylcyclohexyl)oxymethyl]-2-pyridinyl]hydrazine
CID 114342247
[3-[(4-fluorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62465552
N-ethyl-N-[(2-hydrazinyl-3-pyridinyl)methyl]-2-methylpropan-1-amine
CID 62469591
2-(2-methylpropoxy)-N-[(2-methyl-3-pyridinyl)methyl]ethanamine;hydrochloride
CID 115611278
[3-[(4-chloro-2,6-dimethylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 55075282
N-ethyl-N-[(2-hydrazinyl-3-pyridinyl)methyl]propan-2-amine
CID 62469778

Frequently Asked Questions

What is the IUPAC name of [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine?
The IUPAC name of [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine (CID 106449351) is [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine is CC(C)COCCOCc1cccnc1NN.
What is the InChIKey of [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine?
The InChIKey is KATULPRGSMCKQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-10(2)8-16-6-7-17-9-11-4-3-5-14-12(11)15-13/h3-5,10H,6-9,13H2,1-2H3,(H,14,15).
What are the key properties of [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine?
[3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine has a molecular weight of 239.32 g/mol, XLogP of 1.56, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-(2-methylpropoxy)ethoxymethyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 106449351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).