[5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine

C13H23N5 — CID 103061199

IUPAC[5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine
SMILESCC(C)(C)C1CCN(Cc2cnc(NN)cn2)C1
InChIInChI=1S/C13H23N5/c1-13(2,3)10-4-5-18(8-10)9-11-6-16-12(17-14)7-15-11/h6-7,10H,4-5,8-9,14H2,1-3H3,(H,16,17)
InChIKeyNIWYPXJUDVXTMD-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.63
Rot. Bonds3

About [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine

[5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine (PubChem CID 103061199) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine
PubChem CID103061199
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC Name[5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine
SMILESCC(C)(C)C1CCN(Cc2cnc(NN)cn2)C1
InChIInChI=1S/C13H23N5/c1-13(2,3)10-4-5-18(8-10)9-11-6-16-12(17-14)7-15-11/h6-7,10H,4-5,8-9,14H2,1-3H3,(H,16,17)
InChIKeyNIWYPXJUDVXTMD-UHFFFAOYSA-N
XLogP1.63
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine?
The IUPAC name of [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine (CID 103061199) is [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine.
What is the SMILES notation for [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine?
The canonical SMILES for [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine is CC(C)(C)C1CCN(Cc2cnc(NN)cn2)C1.
What is the InChIKey of [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine?
The InChIKey is NIWYPXJUDVXTMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-13(2,3)10-4-5-18(8-10)9-11-6-16-12(17-14)7-15-11/h6-7,10H,4-5,8-9,14H2,1-3H3,(H,16,17).
What are the key properties of [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine?
[5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine has a molecular weight of 249.36 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine is sourced from PubChem (CID 103061199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).