[5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine

C13H17N5O — CID 162702786

IUPAC[5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine
SMILESCCCCOc1ccc(-c2cnc(NN)cn2)cn1
InChIInChI=1S/C13H17N5O/c1-2-3-6-19-13-5-4-10(7-17-13)11-8-16-12(18-14)9-15-11/h4-5,7-9H,2-3,6,14H2,1H3,(H,16,18)
InChIKeyUOUUXQSZSPAMAB-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.00
Rot. Bonds6

About [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine

[5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine (PubChem CID 162702786) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine
PubChem CID162702786
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name[5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine
SMILESCCCCOc1ccc(-c2cnc(NN)cn2)cn1
InChIInChI=1S/C13H17N5O/c1-2-3-6-19-13-5-4-10(7-17-13)11-8-16-12(18-14)9-15-11/h4-5,7-9H,2-3,6,14H2,1H3,(H,16,18)
InChIKeyUOUUXQSZSPAMAB-UHFFFAOYSA-N
XLogP2.00
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

2-(4-butoxybutoxy)-5-[6-(4-butoxybutoxy)-3-pyridinyl]pyrazine
CID 22412891
2-(6-octoxy-3-pyridinyl)-5-(4-phenylmethoxyphenyl)pyrazine
CID 22412778
2-heptoxy-5-(4-heptoxyphenyl)pyrazine
CID 19103384
4-(5-butoxypyrazin-2-yl)benzonitrile
CID 71330453
5-(4-ethylphenyl)-2-pentoxypyridine
CID 138716515
2,5-bis(4-hexoxyphenyl)pyrazine
CID 86183417
6-butoxypyridine-3-carboxamide
CID 506622
[5-(butoxymethyl)-2-pyridinyl]hydrazine
CID 62245667
N-[5-(5-ethoxypyrazin-2-yl)-2-pyridinyl]propanamide
CID 155733906
2-decoxy-5-[4-(trifluoromethyl)phenyl]pyrazine
CID 139625408
2-[(6-butoxy-3-pyridinyl)amino]acetic acid
CID 3028450
2-(6-octoxy-3-pyridinyl)pyrimidin-5-ol
CID 19389361

Frequently Asked Questions

What is the IUPAC name of [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine?
The IUPAC name of [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine (CID 162702786) is [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine.
What is the SMILES notation for [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine?
The canonical SMILES for [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine is CCCCOc1ccc(-c2cnc(NN)cn2)cn1.
What is the InChIKey of [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine?
The InChIKey is UOUUXQSZSPAMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-2-3-6-19-13-5-4-10(7-17-13)11-8-16-12(18-14)9-15-11/h4-5,7-9H,2-3,6,14H2,1H3,(H,16,18).
What are the key properties of [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine?
[5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine has a molecular weight of 259.31 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(6-butoxy-3-pyridinyl)pyrazin-2-yl]hydrazine is sourced from PubChem (CID 162702786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).