[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine

C12H21N3O3 — CID 105246133

IUPAC[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
SMILESCOC(OC)C(NN)c1cncc(OC(C)C)c1
InChIInChI=1S/C12H21N3O3/c1-8(2)18-10-5-9(6-14-7-10)11(15-13)12(16-3)17-4/h5-8,11-12,15H,13H2,1-4H3
InChIKeyKMQCZJRGBGKDCH-UHFFFAOYSA-N
MW255.32 g/mol
LogP0.99
Rot. Bonds7

About [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine

[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine (PubChem CID 105246133) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
PubChem CID105246133
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC Name[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
SMILESCOC(OC)C(NN)c1cncc(OC(C)C)c1
InChIInChI=1S/C12H21N3O3/c1-8(2)18-10-5-9(6-14-7-10)11(15-13)12(16-3)17-4/h5-8,11-12,15H,13H2,1-4H3
InChIKeyKMQCZJRGBGKDCH-UHFFFAOYSA-N
XLogP0.99
TPSA78.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[2-cyclopropyl-2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
CID 105272873
[3,3-dimethyl-1-(5-propan-2-yloxy-3-pyridinyl)butyl]hydrazine
CID 105220430
2-methoxy-3-methyl-1-(5-propan-2-yloxy-3-pyridinyl)-N-propylbutan-1-amine
CID 116720620
[(2-methyl-4-pyridinyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 106756674
[(1-methylcyclopentyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330488
[(3,4-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330468
[(5-bromo-4-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330550
[(4-ethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105197467
[(5-propan-2-yloxy-3-pyridinyl)-pyrimidin-4-ylmethyl]hydrazine
CID 105221122
2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
CID 116718601
[2-(4-fluorophenyl)-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine
CID 105198391
[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330458

Frequently Asked Questions

What is the IUPAC name of [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine (CID 105246133) is [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine is COC(OC)C(NN)c1cncc(OC(C)C)c1.
What is the InChIKey of [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine?
The InChIKey is KMQCZJRGBGKDCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c1-8(2)18-10-5-9(6-14-7-10)11(15-13)12(16-3)17-4/h5-8,11-12,15H,13H2,1-4H3.
What are the key properties of [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine?
[2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine has a molecular weight of 255.32 g/mol, XLogP of 0.99, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2,2-dimethoxy-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105246133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).